ase
View on PyPI — Reverse Dependencies (374)
| 3.22.1 | ase-3.22.1-py3-none-any.whl |
Wheel Details
| Project: | ase |
| Version: | 3.22.1 |
| Filename: | ase-3.22.1-py3-none-any.whl |
| Download: | [link] |
| Size: | 2192122 |
| MD5: | 733184e1cd55ef6813efc268fc8a6480 |
| SHA256: | 66cc481e3d82bea8931d5fe677119932ea0bd1bc08b901fd84f36b37fa681c9e |
| Uploaded: | 2021-12-01 12:51:26 +0000 |
dist-info
METADATA · WHEEL · RECORD · top_level.txt · entry_points.txt
METADATA
WHEEL
| Wheel-Version: | 1.0 |
| Generator: | bdist_wheel (0.32.3) |
| Root-Is-Purelib: | true |
| Tag: | py3-none-any |
RECORD
| Path | Digest | Size |
|---|---|---|
| ase/__init__.py | sha256=6U3MjakJuTej8XVNlplyHk0nivi42OSydPiGPUeAdxs | 509 |
| ase/__main__.py | sha256=-ywa0U2DAKSwnk3VgyvviFgIG0Taj2oqCYovn540z_U | 37 |
| ase/atom.py | sha256=Ik7dEZpFP_ULrXF2StuGWNCb9SKLetXd7UZXZw0Szt4 | 6663 |
| ase/atoms.py | sha256=FFz5raQ9l2cmTwPb2DTRcwd3Ov-Fk7Ic_UfamPjfASU | 71092 |
| ase/autoneb.py | sha256=Ny2p5nhy1XlpQSBphWZfsqRp_0gMDTCPd8oUBTg-MQ4 | 24284 |
| ase/cell.py | sha256=4lpSahdTYptq7wT4QWwHODjI_XrrxM6oZu2DwqiEjks | 11874 |
| ase/constraints.py | sha256=1bg7AjL6m3TNC_LVphtV14V9V0spbcdo2UsR03MXSvg | 100273 |
| ase/dependencies.py | sha256=BMTtKx56QFxzqtWPF3-u7H4RQvld64k3xKEyDgDr2ok | 897 |
| ase/dimer.py | sha256=Zlv48wzpsMVmX1E5hctvqPAs7OrPf-iX5GXawbTHCKA | 45092 |
| ase/dyneb.py | sha256=cHJIPVVroMk7ZsWwPa-03fI90_ctm9xpt_WZ8x-RYYM | 149 |
| ase/eos.py | sha256=QQbrzk2NEKw4HjlMkjgUfTxnNhAp8XeYGUSqyEsHVqI | 13735 |
| ase/formula.py | sha256=tkkOy0jYr7BbIMqrqRLfG9pd6jFKQbobvMFKtTtNQjA | 14444 |
| ase/neb.py | sha256=IJbC8YiIAE6decFdWPbVZEePRCakolB8HoQB6N2Zwug | 46445 |
| ase/neighborlist.py | sha256=UlIA1lq2N9rO2oNkO8SbwEMtwrRHWZRpZiaG3OWHNFI | 43422 |
| ase/nomad.py | sha256=zr5zuvjfeJxo3Lf6Bwza1rKjSvH3nAH-FCfp_IvIxDA | 4370 |
| ase/outputs.py | sha256=fdzbd5dIpyiGL1CrDxgveyJoQkOa2ySy7pkzyqfP5CE | 5273 |
| ase/parallel.py | sha256=iBRL5SavZcuwOsDa-JIgw1_TCWBA9QLp-tH4EU30iHQ | 9644 |
| ase/phasediagram.py | sha256=a-INE27zHwJ25oHOPUbGeyieTrgUDKfLvjJUjzDliMQ | 26838 |
| ase/phonons.py | sha256=L1yPAvWqdSE62Rp0GQ1AfbZeiKExjn2Zghn8qk_JboM | 29031 |
| ase/quaternions.py | sha256=eCXtFuQU9zROJESOFA4idOcExzygj9fI_bMLS7v9yiU | 8094 |
| ase/stress.py | sha256=rpSHtCEtXhP1h4v4OQ9v4IaKUr2ZUm3ttIEdIC268MU | 2187 |
| ase/structure.py | sha256=fhVBJmVlpUitzRti2StbPukMD7sXDXlM0_y8fepWTso | 173 |
| ase/symbols.py | sha256=4Gq7jet5iOBQn6Ru7alWdw4iLAWnEUSCOg8OQcHm2oY | 5607 |
| ase/thermochemistry.py | sha256=boIJ9oyetN_0rZEKnD36nKQx1zl95et_nDHYY6VtRrk | 28568 |
| ase/units.py | sha256=rTtAz0-yJb0K_-5QhgGGw-DJvoacj69LK7a09gcuQ3o | 7964 |
| ase/build/__init__.py | sha256=Sex5VBhlmvKJNXCcu1nKRmU23JrmHaRGhf10H1ebxnM | 1776 |
| ase/build/attach.py | sha256=lhacJgJNHq5gtZHKSAzAl3aeGauUwPS6QyTEziudHnU | 3541 |
| ase/build/bulk.py | sha256=Qua9JnRrc9GxwKdtoGwo-L3Y0bsxkwwuUUIB9w9XGJE | 12517 |
| ase/build/connected.py | sha256=yfGH-iTrm42TWTkGFSaaJq2yCBat2kzu9j3ZhFqcvPM | 2418 |
| ase/build/general_surface.py | sha256=R6DBASUOoC0gkDJruMLrYOBPvJ39Thq8DvGdKXkNEco | 3643 |
| ase/build/molecule.py | sha256=ZAPHXjP7_bOOv-JHuswN6DMHn8wLy0F8R4mSHaT5WQQ | 8204 |
| ase/build/ribbon.py | sha256=IeumHZlVAG3yHQAZchzqaJ_EX5c0MKTnQJxD9GDZu6Q | 5813 |
| ase/build/root.py | sha256=5Rz6_RXCEZinaJGeBC6kgLAXOQ7cXjLDo9kxKcR6OrI | 7233 |
| ase/build/rotate.py | sha256=7UryBRcKGsqX0FdUkWqvSpCK18kfDn58YEvSIAcvBw4 | 2456 |
| ase/build/supercells.py | sha256=kD4DodO9pNc1lg4So4QjArSZwkT0nHOjkm2IBOGaX04 | 7585 |
| ase/build/surface.py | sha256=3YLy8jrZ05pvcbPTXCSnQeHBRGNZU8XdLNi4Jai-YoQ | 18765 |
| ase/build/surfaces_with_termination.py | sha256=P0DgvuYPnSUXheS-8m5cteaEYKj-EPdAzmsqc-96bGs | 6372 |
| ase/build/tools.py | sha256=E6NDYYJwztTrUR2M40fo6NSkbLf2nNoTGkmwWXjvRfc | 23261 |
| ase/build/tube.py | sha256=Y0dGewLk38E2vz2B-UB7jscBQ7Q6_mkTlWh7J7rm6pU | 4679 |
| ase/calculators/__init__.py | sha256=Ls7AaRwW3wr8sc3eR7TccuvsbZF4z2Gk7H_HaqpVkAU | 64 |
| ase/calculators/abc.py | sha256=9oAem2ypr8GGwelpgKLrx775efBopPwusj4Y-S6-02s | 3283 |
| ase/calculators/abinit.py | sha256=CzQRKcsSykbzjpYBGDtKAwZiPTUVsApIkbRaMKp-PZY | 4702 |
| ase/calculators/acemolecule.py | sha256=evP20y4JItmczgSGQFACZqpfhlLs9E_bAaW5jE82B2A | 11493 |
| ase/calculators/acn.py | sha256=RSmno0SpZuLgL9jawc0gJB23ub2zxDdMCTVed5dqdM0 | 7914 |
| ase/calculators/aims.py | sha256=gwdaDFZLxYPeKc22j7hrremDaZHto3w2RCD05yX9uWg | 36991 |
| ase/calculators/amber.py | sha256=rAZXhHR_dbTGfMJudADkvvcIrs0MMtMH_Ds5W9TenvE | 14525 |
| ase/calculators/autodetect.py | sha256=EytelsC4YaLhknD9MJtJvNMidnu5xWiAmCP1ggn5_x8 | 3229 |
| ase/calculators/bond_polarizability.py | sha256=njFTvz60sgtR_T0A3WTJK1rl567uvKmllYbPMTPPbzU | 4647 |
| ase/calculators/calculator.py | sha256=YHBmREGXuR-Xg0ZBMxFX54rtz3e713nf_5BF_a-1uaw | 33304 |
| ase/calculators/castep.py | sha256=EmNpReFy9feE6VTbgyP02KXFasHfkgH3CThda5SdHI8 | 129099 |
| ase/calculators/checkpoint.py | sha256=vGM4iLsTMQpQLyv42mqR09OiQBjix8ZmBZ8p8azZfF8 | 10518 |
| ase/calculators/combine_mm.py | sha256=zJYdsh2U3yfabSOSgakAd3_leNvrvVodC0lhdtMeEuc | 10576 |
| ase/calculators/counterions.py | sha256=Ofpnpf78LzAdeJyfeF0bK9pmjeq6RWeQ_WqUlRFu4BE | 2776 |
| ase/calculators/cp2k.py | sha256=bAy1a3Bi9ZShkig9MOh1kQ7zNR5Zj6uI6FXk8NnF6Ho | 24334 |
| ase/calculators/crystal.py | sha256=vWTMoBqULzSx7H2lVe7aoKCvp_VXQZFurW79o6V2sDY | 16996 |
| ase/calculators/demonnano.py | sha256=8EOycxSNu6vEDuuybt_RKU3frUHiPR9WVWy_PVtPpQQ | 11744 |
| ase/calculators/dftb.py | sha256=NGSsTcGg5eNhCuVh4uBw9ZUHVlXfJY5U9I28jPWIRYM | 22035 |
| ase/calculators/dftd3.py | sha256=RPWJA-t_mpNs3RaK5h2YnvWrD89PXnTDq8CqjxZPKns | 19761 |
| ase/calculators/dmol.py | sha256=yL9zNXseokHpxuBjzCpjJb_f03fp1VjyvHOfJ-Af_gU | 22240 |
| ase/calculators/eam.py | sha256=yyM5h8-y-c2S_n4Z_QBWtn2oGVg1rukkNVQgn5h_FkQ | 37033 |
| ase/calculators/elk.py | sha256=oNzir1wDRGDeAmVNFec8_DJCTL90a5TG6zPxR-BFdpM | 1555 |
| ase/calculators/emt.py | sha256=X7f7YDH83Z2V59RoiODAm-4YyEQ3hNtYfFW6xTJHGjI | 9397 |
| ase/calculators/espresso.py | sha256=kczXetoPgsDvWI8yFLcppjmFIo6dHeFZOpalwDCjur4 | 6314 |
| ase/calculators/excitation_list.py | sha256=rjxHy8B-UEp2wAlZ_j52teRR8LVucurctOtj45KjnaQ | 4582 |
| ase/calculators/exciting.py | sha256=uaQz5nOQuZFbNCLk8iROFmtQ_fP8Uo0S3x3eGCMC9dc | 6424 |
| ase/calculators/ff.py | sha256=7uVP3dgnNOTefkycbmXmig6MxnyFeFDDD0-dsSQpuE8 | 6837 |
| ase/calculators/fleur.py | sha256=D9XZWXHWMq14s7qw3uZe88tkBiU_WbRWKo2XjUIr5zA | 20624 |
| ase/calculators/gamess_us.py | sha256=MozJckDcvnaHpYKy8KpoUzUlDY0CnAry3-5ec8SaL3M | 4047 |
| ase/calculators/gaussian.py | sha256=vpeqHhbp7efZ0KylKpwyctJlSX4w4-VdjlRTBFUpP_A | 4200 |
| ase/calculators/general.py | sha256=39YMnXfGfrvaeuRz8Dx6vprxEKyq8nTCz25NZBawMfs | 1763 |
| ase/calculators/gromacs.py | sha256=7WJ2a7_w-IggD77v4aRqGdugchPopsDZhQadrmEsBos | 14816 |
| ase/calculators/gulp.py | sha256=BmUVQZSqRPEm-1Dam2BciZ_IQ0AbhQmafQV8aQY0KSQ | 14044 |
| ase/calculators/h2morse.py | sha256=QrL23Zr2ct9L9b9HuW1vQ2G4zvHrT5ZeIkk0NMz3Hwg | 6870 |
| ase/calculators/harmonic.py | sha256=h4jfsomoeNr6xdFl6vtGCPecfLSEIGnRTieIOjd96RY | 3178 |
| ase/calculators/idealgas.py | sha256=L9VAvYTJkbHGIVkt8OAd6LqoYoe2XULjMga0GWrMYkk | 1097 |
| ase/calculators/interface.py | sha256=Ppv61cCS1o8MEvnvSUzm7BaulrnJz3rTHxGdLtFx6cA | 4637 |
| ase/calculators/lammpslib.py | sha256=v5NsQXUgdVSCF856PJUFstxEoji0BmZ8e-1TFhfkncI | 27970 |
| ase/calculators/lammpsrun.py | sha256=Fc794v0OVvgShGVgh7NqGogfvrPGY-kt3ziWS1UayLc | 25170 |
| ase/calculators/lj.py | sha256=6CsQKybRj5qQ2m2Dt2zc9X92s4qHDVQHtyZ72cdrOoc | 9358 |
| ase/calculators/loggingcalc.py | sha256=luDNOJuyw39LWUhBDyNQfttUY1-X87HOL-0jMUh2JK8 | 7145 |
| ase/calculators/mixing.py | sha256=DMlc_I2uGBZ3dJb6eq6AL0lWWa7L2xmJOAoBS-9LnTc | 5801 |
| ase/calculators/mopac.py | sha256=Eq3ZnbHVHMgKk0aZv7EDTVgP7vwGbY4S1C1unV-M_aM | 9591 |
| ase/calculators/morse.py | sha256=5x-KcOn6HQdBYAh2f7QK0UcIaxAfAbYqXW5EinlA-z8 | 2730 |
| ase/calculators/neighborlist.py | sha256=V0Ko5CIYHDcPmPs5mqg9Ymkj5zvqbgs0MEDlxfLLCao | 129 |
| ase/calculators/nwchem.py | sha256=iSxdWtRTR0BWY5-Tkqp7WD-kLO1f-GmD-o8R8o_-sG0 | 6500 |
| ase/calculators/octopus.py | sha256=qM0O2gnYUYPRKIjx7Hv9QSxy8hxYJqHCsKyaFbB5nbw | 7457 |
| ase/calculators/onetep.py | sha256=G8rAjJxVLpe8AUGm01No1Tvtx9nrwNCDsn47PS5UhCw | 26855 |
| ase/calculators/orca.py | sha256=O4QI-sWdMjd_Tm6GP9Qr6irfu4bEBHVLH_YPLgnhZV4 | 6212 |
| ase/calculators/psi4.py | sha256=d1_eO3YhCPIt9seZyap6z-G0ABtXEedfjDbC0Kq4f0c | 8178 |
| ase/calculators/qchem.py | sha256=ZPQSc-GVgmsUE2P8_6lwAdv1ddrfLAzdoM9gx1jYEVg | 7262 |
| ase/calculators/qmmm.py | sha256=UyIECLorn9zSmuFmpCinW_kYTEQcO0wjf2zRhm5tEik | 32166 |
| ase/calculators/singlepoint.py | sha256=YzaJ7yrxI9_Kfr1rKPw4gVU8nJHF5pQffOnpPYwE_Dw | 6278 |
| ase/calculators/socketio.py | sha256=wfLKZf6oMijclqNKfT-_frjAh2cNfuWRNkdOwodX8HM | 25608 |
| ase/calculators/test.py | sha256=wyCKroWNiUeDlK-mYn0MCPQvYFLfFE6y5rEHNzXfDnc | 6084 |
| ase/calculators/tip3p.py | sha256=zD9EtQEanL6Ku2maq80uLD1tnkLJEdMjoHgGAdq5zb8 | 5434 |
| ase/calculators/tip4p.py | sha256=wGeeJcNO1-xjcVvKC0Wet_R20o8JSa7XNxQWMApvZqY | 7347 |
| ase/calculators/turbomole.py | sha256=nd3v2bmh_lX4Rhi0i2rd5R4tWYR1ynAsqoJasknJxas | 79045 |
| ase/calculators/vdwcorrection.py | sha256=_HHUE9UB8eKts8PuGeueJwacaj7FO_ENM_tZaIvSHLw | 13570 |
| ase/calculators/demon/__init__.py | sha256=8X7-7zLoMerpwRtHAYepPFP3IOjjNOeq3z1XXJQqhOg | 113 |
| ase/calculators/demon/demon.py | sha256=mHdLQlfhjneleRgqFa5kNjv6OVv_lG5Hq3Z5c7qC5Sk | 24839 |
| ase/calculators/demon/demon_io.py | sha256=JAkXVzMKQ4VjsEtQtMoBT7hMXxi2XZ2MSqUak46wIGc | 1112 |
| ase/calculators/kim/__init__.py | sha256=jkthtvJNKGUzX2HptRkgWNNHqseX9SWJ-Up2ktmb95E | 148 |
| ase/calculators/kim/calculators.py | sha256=6ib07T2Hec09eFx-Us2XoRvsZKWOrErA25Ql_es4gO0 | 8581 |
| ase/calculators/kim/exceptions.py | sha256=NfSxlI-Ukc9PtgcrQ9z2AiMOi_VlpI7McSRIZMTcRhU | 1022 |
| ase/calculators/kim/kim.py | sha256=nUVldcL9Lmrv6HrseE_Gms7x27O1XiAvI9BJRDpcT8w | 8002 |
| ase/calculators/kim/kimmodel.py | sha256=T2v83Glk1W4_iCJ1wcj979GMu5yz0xSXRb4hjYOTCkA | 11981 |
| ase/calculators/kim/kimpy_wrappers.py | sha256=zH1z_-zOmUjarc_h-jOxizNKjd9X5GNE185G-T_M1gs | 13916 |
| ase/calculators/kim/neighborlist.py | sha256=Mk6oVpDjs3naOA4CA7k9sLIFtv8_xgvB9rWqtxRGEKY | 16228 |
| ase/calculators/lammps/__init__.py | sha256=aglomCtugHAYfS6_N5ZRivcKxT9C5-eHpQb1OCtTMyk | 270 |
| ase/calculators/lammps/coordinatetransform.py | sha256=DY_UuYb6wZhhTRSaFtaustg3fg_0UH96s_Y0JKbq098 | 7860 |
| ase/calculators/lammps/inputwriter.py | sha256=_KKRT7XnKvGitkeveHcBesLUz6vCto0PEqAPhGuGKL8 | 8744 |
| ase/calculators/lammps/unitconvert.py | sha256=8VgJFjsws2YkADqoZnJWJRKVzADuyZrDzTeI6ypnwp0 | 4891 |
| ase/calculators/lammps/unitconvert_constants.py | sha256=rMXAtT8lCT0BbCUueT03NSE3uIaG8LAws0fODSyx_PQ | 6107 |
| ase/calculators/openmx/__init__.py | sha256=yx3yjpXs_77WzjHdAWp6VRm-x1hJocCRn0iBW-Rj1x0 | 96 |
| ase/calculators/openmx/default_settings.py | sha256=DVI11P-Lzi2XZrkPf5r-byVHezrsx2XbesyH_Qo-Tok | 11249 |
| ase/calculators/openmx/dos.py | sha256=v3URa44CUxllpNXEW2H89ZBV16pxMBcEyIw8QSu06Vs | 23887 |
| ase/calculators/openmx/openmx.py | sha256=fCcj1jzap2bv9s5VDD9cxKM3FJyMDqjPa2JEKbn-jVY | 27550 |
| ase/calculators/openmx/parameters.py | sha256=c3MJPxtpE_rOJaPSQe_VBjAqKivCbaueoKX3IbSOIa4 | 9258 |
| ase/calculators/openmx/reader.py | sha256=SviTukaGfvJRXayq8bR2--ULEEFy_M0pPwR8cQX5PLQ | 32007 |
| ase/calculators/openmx/writer.py | sha256=B3ZWbBlahLkQ7-BLM126ATQMKH5bxYKvqymV5dusgBI | 25872 |
| ase/calculators/siesta/__init__.py | sha256=0uaP1ilC5OkHnurW2ZsEKWSX33gQecX5sDB2qU2pvZI | 207 |
| ase/calculators/siesta/base_siesta.py | sha256=MonMkVpOKSGM6Q693j4L2k1GK9Y-ijkZlOZmbJC2Nk4 | 461 |
| ase/calculators/siesta/import_functions.py | sha256=tKDjaAhdQYjoP5NU_5HzZwa7G6IEJn5Mjr1nNZkziFE | 12782 |
| ase/calculators/siesta/import_ion_xml.py | sha256=13sKDnDk4I75LUSiCvp5oy2ymSlT7xh9WO10W3nZO8A | 6384 |
| ase/calculators/siesta/parameters.py | sha256=Hm0KTgivNnkqgAc6XXiteVd3NwOhhV-h2fiD1n5YOQA | 3246 |
| ase/calculators/siesta/siesta.py | sha256=_q2ONbErhZHICvT39GYk83H1u6D_SK7rRVnxRnZa1-Q | 46161 |
| ase/calculators/siesta/siesta_lrtddft.py | sha256=WV_QRScl5Fxk2AvtUvipSYasUE1yiWSCX2edRNl-enY | 6431 |
| ase/calculators/vasp/__init__.py | sha256=OCVb-oR0yec9BZzNAfmtItM29aT5oBViBb2T63GO93U | 327 |
| ase/calculators/vasp/create_input.py | sha256=rQ4gG8cu2zIR5y_mWLaqu-DTwjt-iKyHY-KwBCF7KKw | 85442 |
| ase/calculators/vasp/interactive.py | sha256=YkrG18Rs_yA1FJjEXV0u7f3e2vmHCsun3FOBY8OogpQ | 5276 |
| ase/calculators/vasp/setups.py | sha256=cMwmTZREAEGSMATkfvaq__4KiHLQVdNuI4wGMmeoug4 | 4828 |
| ase/calculators/vasp/vasp.py | sha256=G28lv7XFwzVM2-p2QrcLcwoSHxsECL13Xb_8m6ZUtIQ | 42771 |
| ase/calculators/vasp/vasp2.py | sha256=EgDaKsKDsqSxEz-RKL340UTxAMOLRYJQbTZGRMySFj4 | 966 |
| ase/calculators/vasp/vasp_auxiliary.py | sha256=xTbMbQHua1VuPVFU-WPtZX3WXUs1YGdvnd22_r8HTHA | 17706 |
| ase/calculators/vasp/vasp_data.py | sha256=8gSf81YXUkH7OAvECJLb_kBjbkWzHpzpnRXZhQAR-4Q | 6395 |
| ase/cli/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/cli/band_structure.py | sha256=ysw5KdOLyF_gFCVmE8tSy9_HeTYhekyQrUyNMftzOSQ | 1617 |
| ase/cli/build.py | sha256=iJ-2A8a9tibY1YbGlMDUGACtgIFM1xKuD60JkI0YUEE | 6590 |
| ase/cli/complete.py | sha256=li47QjM41ZLbb7mFDaMgX9-RFDz9RYeef1TW0lb6kgM | 5293 |
| ase/cli/completion.py | sha256=9WjnNDr1ZRyiaKKqrLjPIAXHuHOJP4uZdMRGgjPVX7I | 2742 |
| ase/cli/convert.py | sha256=7lWBE7fA51R7QX3EQiZ4kdvopSohKf7vHQkuWFh-Vxk | 4774 |
| ase/cli/diff.py | sha256=zN_JCkcKHTvscHdPix5aLiWSGN_7ptsw3iV6UXJ-zKc | 8376 |
| ase/cli/dimensionality.py | sha256=bVSVNQCQJuMABQwYEMITmHUVcFGt0LgzQfrzkz2RIrM | 3451 |
| ase/cli/exec.py | sha256=-6HNzCzntQoqdvemEfnfIJFseUC1Bm90V46l5VEif84 | 2746 |
| ase/cli/find.py | sha256=jzxM8b8tNDTX3DHLp7nKlIK_t2ott4fFvjNTqqnpOsc | 3912 |
| ase/cli/info.py | sha256=0h0yjGbuRTsyp4BhXAIVx2bI3XFQfkJKV7PJw-ztL2s | 3864 |
| ase/cli/main.py | sha256=YtFq84cHdGBCm5yjeifK5mgX5WG3b3xre10nZRmgnK4 | 4933 |
| ase/cli/nebplot.py | sha256=28oXuqvTTTedeShyR8IDE8w8vPbNG69w7GPiH5z0Pug | 1641 |
| ase/cli/nomad.py | sha256=NcUfxcwoTjxv394QRDFH1ut7GJ6dsHrcHG7fiQOBPAU | 2741 |
| ase/cli/nomadget.py | sha256=js_PH6P_IPtrMaRULxXRSYSczxUOtjH9rvhUGNqtVR0 | 634 |
| ase/cli/reciprocal.py | sha256=b4jBFkGJurZxD_82vi908rtZ0fHEhgMUMT8uC6Fp2Co | 1955 |
| ase/cli/run.py | sha256=VDvjj1Td801UTd2DkcGNdaiqwJ71wOnHHEC-RP87j2E | 8276 |
| ase/cli/template.py | sha256=9u3npBI2uxpACUTr0T9ymFEoee7nufilwmdFOBIRnBo | 10594 |
| ase/cluster/__init__.py | sha256=DFzVVH-AmZzm5cpm8GMgfxmy7oHr_HBiBWIaFDzQyYw | 618 |
| ase/cluster/base.py | sha256=rfA_n2f59uhpzmLNGJNDhpZ2QIFIk2AmINj75oMmuV4 | 4459 |
| ase/cluster/cluster.py | sha256=DgXcJL7yMP4WyVVaTvNxgES1prsTtSUHlNlfLosWbC0 | 2554 |
| ase/cluster/compounds.py | sha256=lTiIAohVmzeR7E2t-VJ9dGyaWvEcL4cneOeBSbyA1GE | 486 |
| ase/cluster/cubic.py | sha256=j4msY5ftPJ2dEbTzhtU1jmCONBuloYqVQIGqaqQot_Y | 1808 |
| ase/cluster/decahedron.py | sha256=YCseBL8yQ0UiCS21wJY6foOKmq796QDrXRH7k4amfGk | 2725 |
| ase/cluster/factory.py | sha256=C_XMGf30wkNsFM3S0wrXTSKsiuSOLEauwYk4knLycS4 | 8629 |
| ase/cluster/hexagonal.py | sha256=JbPvAXk5XIFPw088THRinjvfE1Jb9Ow12NH0xlxdcsw | 2732 |
| ase/cluster/icosahedron.py | sha256=CUcc9OKNursU39zmnR88nrZm6lBHZ-HG3dJ9qA3v7zE | 3653 |
| ase/cluster/octahedron.py | sha256=dJbu-hEDZGhGtJ0VlPkmysqhUBFKPIKWlPDtquBL-BU | 2046 |
| ase/cluster/util.py | sha256=UHnZlfZvOcQLfj7SA8zxfnFXRtRMZ0VHJhDODhtEN20 | 914 |
| ase/cluster/wulff.py | sha256=SyfIDXPD8l-IeP2RPOf9YYutJNBrvvIMju3567jAigQ | 6843 |
| ase/collections/__init__.py | sha256=u6vb3RfRZ2Rhd4KHuszlTLhZbdRmiVcnuJqXfSjMW50 | 124 |
| ase/collections/collection.py | sha256=TiNqpwcFmVF6Xm6HcB3sej_URRB99pOdSRtFtYjj0xI | 2473 |
| ase/collections/create.py | sha256=V5iRJPIKZog61BPGa5403mAzNfK8lmxN4enHhdzFb1E | 1893 |
| ase/collections/dcdft.json | sha256=sLX3VSS-4LVO5inhQ9r5q4hAAoKnp9nhPlKi_MEMlxs | 47588 |
| ase/collections/g2.json | sha256=b42eB5di8qe2QvOAkYssHNHvI4iD1kLNTGa7KQ3mJ0o | 61935 |
| ase/collections/s22.json | sha256=VI8Wp73hkHvb1AuHP_MHQZ5DkXdaTfIrTMBjoQqH64Q | 20518 |
| ase/data/__init__.py | sha256=A6RQvgD67ZHGDLkaPlbNDZ8_I__Tcc7qTgA2ea1w3tw | 21462 |
| ase/data/cccbdb_ip.py | sha256=G63vXt-i0KCR-g6uhgvO8T_fI41SmdQianU-4s9Wubw | 2711 |
| ase/data/colors.py | sha256=9tI8moOzZumD80rX1On5uWUacBNESjvGNer7aTJ9qTQ | 5737 |
| ase/data/dbh24.py | sha256=suZuZApANRQ4R7S8T0eCMXKTSfdSNipVNA7ZRf0H-P4 | 18044 |
| ase/data/extra_molecules.py | sha256=H_iDJMCIt-qfmNV6uY42CNJBI2ORfa-Jx0UTkLBKqX0 | 7235 |
| ase/data/g2.py | sha256=4_cYJ8qF9EZrRNsHnwmOKK7xF5YUCbI1pOVxCvaemW0 | 1875 |
| ase/data/g2_1.py | sha256=0AtMw9rQ8DOqRgqhMyG-8ukTTDaRrpfP_dVz9qLTpmc | 36361 |
| ase/data/g2_1_ref.py | sha256=cq4GOlBTIf8IYBoQHLeho6WYMx9KAmpPRa9-mtxJmk0 | 10516 |
| ase/data/g2_1_ref_g03.py | sha256=rwje5jW6tAsJ9YySIl3QJa38TYoTqj8x_TjJP2tueQE | 614 |
| ase/data/g2_1_ref_vasp.py | sha256=Sv9ICwsnrUJDxKqgbHXcRitwcx978_uW6bbUWSlwMao | 614 |
| ase/data/g2_1_ref_wien97.py | sha256=TLwC0Tyyu14Qn1y1w8WJJFgpRHSs7Ko83Xw5z1QVWrU | 488 |
| ase/data/g2_2.py | sha256=xlEXns5cSAtHHmbIPL0natquOHFX36DmJ2w_vuU5VXE | 77632 |
| ase/data/isotopes.py | sha256=uABIxSk_ztewLZweVygAv9uAB_5lrHApRqhcpQ-XCxo | 2798 |
| ase/data/molecules.py | sha256=b2I2nSh1yumktV7cVM7H74PXcA7FbADN9E8k8netm2E | 752 |
| ase/data/pubchem.py | sha256=Vl_Gh961QYbKTcr9jch8vU_MH4vo9c1u4rxXN1-ofK4 | 12809 |
| ase/data/s22.py | sha256=mycV9IdOg0qD4v7zjDYVBchkhyVokwEVoZVWvE704ss | 199050 |
| ase/data/vdw.py | sha256=7FinIVnzYOu80sVFwKDFDQPjzjtKsdiW0rYwsGLRpB0 | 3020 |
| ase/data/vdw_alvarez.py | sha256=QzftlQ2VaOqQ1i2av6m4VUQv8IJvNX8RLh3SzrARZ_4 | 2292 |
| ase/db/__init__.py | sha256=T2P77rcu_Hxge6ndobSqty0PphrzGNpROs-5G5-z2OU | 54 |
| ase/db/app.py | sha256=hULl4t0E9rtNqd4sovPLf18tbCkazcGWXzuE6LGuvoU | 6073 |
| ase/db/cli.py | sha256=yrKk8AjstqUuN5xPCv1cj72bS2p096_iZX0LlXhMvbg | 15363 |
| ase/db/convert.py | sha256=NH28rTzMtfwexQoSds3M4amIq7omEMakualCIYjsfEo | 1888 |
| ase/db/core.py | sha256=1dkHrJ_AudRNYACc7YssIaE-iURVjewyTa6YLUr5rxY | 21983 |
| ase/db/jsondb.py | sha256=5emzylZJkxAeLpGFSvvNEzc44XKYTtyEU5C1Nw6yNx8 | 6459 |
| ase/db/mysql.py | sha256=LsF4pOHqLFX3PuJoLzD0UZmqmgcnB5Q4Kan0QgdgZ8o | 8837 |
| ase/db/postgresql.py | sha256=OsADxu7Qg0RkV05K5doum15oKMi49z5ZXbDLV3h6LuA | 6667 |
| ase/db/row.py | sha256=sPey-ji2_3p5jZhcmjufmkp1kHTxLs-5GodYIkq72C8 | 10489 |
| ase/db/sqlite.py | sha256=RqDLmN-gKU2_o5aTq7YQ-wrthtMqeSbqNe4G43CyTnA | 33495 |
| ase/db/table.py | sha256=u3DVZEg3db8YVOeFNCzBawyN5mVyywvdFOJtSREUK04 | 6226 |
| ase/db/web.py | sha256=iSA-JHGU7TTx3sGQohlsrIapVkUJk5elsEgf1sdC80M | 5226 |
| ase/db/static/row.js | sha256=s9INZl0MNtTaTJ5aG30u2EUmGlvUFqqnj_babYbakUE | 759 |
| ase/db/static/search.js | sha256=dCLNqZ_NPNvaoUG2yaPw3uf90Z3NWSZG1RY1oU0mSP4 | 728 |
| ase/db/static/style.css | sha256=6bofR9N3cxdLMIxPObpM9k2sM49Qn3lpndQK1LGaO0s | 755 |
| ase/db/templates/js.html | sha256=oOs7TcetnAAYBabNF0rjsiyW1zR0XeFyDGycqdlsZXc | 613 |
| ase/db/templates/layout.html | sha256=ClMLXmlDl-E8rgpeDHlxWYBqoGVNKwVeAakULxBi15s | 745 |
| ase/db/templates/row.html | sha256=P5TtVBzowdrPBPRX1vSgVD0knItv1AwUHp3GlTEU-Io | 4333 |
| ase/db/templates/search.html | sha256=Kyi0RW6K4ACvux1vPClgP-dWwhL-WgVaNg4I0-hL4Gg | 2482 |
| ase/db/templates/style.html | sha256=V11FqXnCLRy4X0HlRROvlCk6H064GKxAvWFBDTlP3Fc | 859 |
| ase/db/templates/table.html | sha256=WWtGkk62MURnVz8HJcAwMxWyuMxHx80ROcZKj2pZL3Y | 4235 |
| ase/dft/__init__.py | sha256=w4Kg9iwMI-11Rgc6Bn-CzN7zWSSCpfLXSYqv0irFA2U | 740 |
| ase/dft/band_structure.py | sha256=ef2f0ksxzn10h7yQP6eagwLIyAXj71GDT0s7zd8upWk | 384 |
| ase/dft/bandgap.py | sha256=g7bLH_PEUWxKpUmiifvrcLxD2GGM5ePLIw7HB5O6S_M | 5594 |
| ase/dft/bee.py | sha256=vVM7lwiwOxKiefHf5pwQLglEliP0jmYJBp33bpONwHU | 5790 |
| ase/dft/bz.py | sha256=OBl4Gnp5xJPW196BKB7_izBxONHycfFLA4p5tKgW9n4 | 8420 |
| ase/dft/dos.py | sha256=otQv7I0t_AAeYasUXD6-iXs3pQI5wnJ3w1n-g9ARq0k | 7909 |
| ase/dft/kpoints.py | sha256=TIkCCRMywe2-SBwM3w2lYUahOR8ePhnTWWi2NZmFxIY | 34552 |
| ase/dft/pars_beefvdw.py | sha256=gifTBWOu9aRgiPPile2FHvlP6L2GQiRhfs8FQPdIXzk | 23680 |
| ase/dft/pars_mbeef.py | sha256=lgW5Cit4FHwvq84M-pTBKePiZU3smQ846p2ySoGXJ7Q | 75989 |
| ase/dft/pars_mbeefvdw.py | sha256=p4XECqCHh9vYKeCGsvrb1IIGsyZIAuRNTN3vEXeWb3Y | 14649 |
| ase/dft/stm.py | sha256=gIxMkQS-tuvjWQ4NwUF1eljE3113s6q2CK3iczHnQHA | 9372 |
| ase/dft/wannier.py | sha256=5ln9LNeRqAcRPtEruKJbWtDUKimHjG80NS8J3QGYYRQ | 28878 |
| ase/ga/__init__.py | sha256=Td5H6JxZ9p9YQiWmJ8myaIHx_rXPt5EvvVhIxjV6J0E | 1782 |
| ase/ga/bulk_crossovers.py | sha256=X1vqBOLfjg5kDu_eda-jn_0idOmJdVSXEDlOqZ2nNoo | 295 |
| ase/ga/bulk_mutations.py | sha256=KeH2HE4A2tW0pQw-nIuG081HyXPm8Y8ftmC9nDS9zoI | 330 |
| ase/ga/bulk_startgenerator.py | sha256=voCSU9HAWi9m5cnMHnxv7oVqa6tbBVHTxjSRHsrtdGI | 289 |
| ase/ga/bulk_utilities.py | sha256=SeMNFGP5RDH_3CFvndZdTm13H23oyEtUS8K3xnM-q8c | 177 |
| ase/ga/convergence.py | sha256=5ZGRu22JtZQXL18vxYHTo_63ODzI_3-2WwyleDr8bGg | 3458 |
| ase/ga/cutandsplicepairing.py | sha256=74OPZKEyGzmwa3U937XXlRIJd2dT6MF8mrbznzQAI6A | 18012 |
| ase/ga/data.py | sha256=ZlsiJ8wvcR8UQFlIqoTbFPjv8Qd0woZr5GkwFPnbBaQ | 17397 |
| ase/ga/element_crossovers.py | sha256=S7gRgylKVrQSHDBYoIPMkYBleQ4u3rTC1Pc41VCNo8M | 5640 |
| ase/ga/element_mutations.py | sha256=t_bD4skFoqzdsXsAMlu43kSGupejr7itSkcb6zgZbWc | 24795 |
| ase/ga/multiprocessingrun.py | sha256=-62_j32C6xob7w5reQJdMeYF8iMfrNTU4gmp4DwXskU | 1930 |
| ase/ga/offspring_creator.py | sha256=OJv4DP6UujlEoReUAJOW_W9AIG70vsWlaFvEiGH_Jw0 | 4279 |
| ase/ga/ofp_comparator.py | sha256=c8sQt1PieMnWHCoidOvu1WJCFPsK6BvGpZwV9HDjOxc | 21065 |
| ase/ga/parallellocalrun.py | sha256=usTWcOqHBH1piNCeXTSga6j6paqE5PYayf4qwN76XbQ | 3372 |
| ase/ga/particle_comparator.py | sha256=rzkoitHOyxCfw2JnZKcomrnwsP4cO887FcLA32jDki8 | 1238 |
| ase/ga/particle_crossovers.py | sha256=5fMAhnoLD4n2RaemELsW_FnZC0vldfL9JUI_891ubpQ | 7339 |
| ase/ga/particle_mutations.py | sha256=z0Yk2AxMsibwcFgTAgTCvcY4VIr0xUXetvGeZUwoH70 | 18932 |
| ase/ga/pbs_queue_run.py | sha256=dG-1nHxenAWnh8XJsndz3P1ASVysLO2BsOgkW0Mpb_4 | 4857 |
| ase/ga/population.py | sha256=00RY6RFk_sr2Mc6QHxxoO9wjKZxkBzJyCG5V729hd9Y | 35231 |
| ase/ga/relax_attaches.py | sha256=0l8wEh-stVhKmxOIk2E6GUHQNn8O_CG03Srx52qEgV4 | 2503 |
| ase/ga/slab_operators.py | sha256=-L6b6euf_TQ_sE-FMMa4zbIGVB_3kekoqQ7LTo3Yr80 | 20299 |
| ase/ga/soft_mutation.py | sha256=TigjilJWxDB851NGga8sd0KX9b91BfRi4GG8IjKE47E | 14324 |
| ase/ga/standard_comparators.py | sha256=90ZacGDs61tn9xGx_ToatZcs-b64B5OivTRmbrnW4k8 | 6269 |
| ase/ga/standardmutations.py | sha256=inQKU5zcg7YMwNo4br-pDV21rl7AayRLhHTiZKSiCNc | 24346 |
| ase/ga/startgenerator.py | sha256=gCjLhiyUgDd_nDg2l2eManWwqmIIjtXO8iPdcP5S4Cs | 19419 |
| ase/ga/utilities.py | sha256=COXwJEbYAgvN4V63NNqneX608svwQKkR69VfE1g95RQ | 22966 |
| ase/geometry/__init__.py | sha256=rmmnEc7FTsBPTwtHevnbsgYHi7Eghx6cd_Q7ueZ1bgU | 1352 |
| ase/geometry/analysis.py | sha256=gi5ZXGp-pOOoAFchfZFlVp-h3BoRj8gFhVute6UVO68 | 22388 |
| ase/geometry/bravais_type_engine.py | sha256=xdCjUJlFE5pXb28E-meg_M-e-fe8vWHhI_HOwFwA4C8 | 9255 |
| ase/geometry/cell.py | sha256=KWyYl_HfVyUQTN5zwh656hy0Dk45wIpiwgQB7DVrS30 | 5507 |
| ase/geometry/distance.py | sha256=vH4Gsb6OV3k9EA-jcGlyxG985Wq_5210vbbVblQYpaQ | 1796 |
| ase/geometry/geometry.py | sha256=akEMXHwwLZHwQC9G8VGpjOomVLsdNUKHfo3pBqNxJas | 16232 |
| ase/geometry/minkowski_reduction.py | sha256=bz4M3S_Ck7dBbgcP-rIfcrgzTlWNMxaf6HrZNaVOpxo | 7956 |
| ase/geometry/dimensionality/__init__.py | sha256=vRf9fpjV0kBCTdd2TlmxK_k9o6L9Drpi0pQvMlNOWy4 | 245 |
| ase/geometry/dimensionality/bond_generator.py | sha256=7rYg-b3bY9yOiHwkSDxw5K6mnMD3l4iZN56tBkoVwzY | 1685 |
| ase/geometry/dimensionality/disjoint_set.py | sha256=v8PHy2JxjSvFI0-f54lQ4Z5N5HIpWjSoGDennfZ9itg | 1389 |
| ase/geometry/dimensionality/interval_analysis.py | sha256=mmJ16qano-GfSiERf-IVq2zfQicBloL8E_YstD95be0 | 6034 |
| ase/geometry/dimensionality/isolation.py | sha256=pd6xUzmY3gfF8wfP8yTxG4vPrjM5a-y26HO2QgJhiSA | 8607 |
| ase/geometry/dimensionality/rank_determination.py | sha256=-jHTM2QaKFiT5pUy6nfQ3hBtgR_2uHsm7KCl9eEeH9g | 6358 |
| ase/geometry/dimensionality/topology_scaling.py | sha256=UqcL5TUpwT3o7G51ECHSQvvSNBQUafCUzQkVte5WYAE | 3284 |
| ase/gui/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/gui/add.py | sha256=ebGzLzKo_uh0yhrUUZc-ykbPbZKHhEjbMMrLm7IV07Y | 4838 |
| ase/gui/ag.py | sha256=bO9B0UVri2npN6jFLukB-WzgTxVohBJ1psUeyeLUQTk | 3884 |
| ase/gui/celleditor.py | sha256=k4FM8FdVznaVkZfMNiYYL1Ey0b-z_WIC6Mp2Z9rqHEw | 5535 |
| ase/gui/clipboard.py | sha256=Xj3pGRPIos_1NrVJ0J6a3WoOqX-qofeCWpSvrn2N2Jc | 708 |
| ase/gui/colors.py | sha256=qym6qxr5Kxg03kmt65ycCHB-SDovxhFAVgvNUPI4WJw | 6129 |
| ase/gui/constraints.py | sha256=A_Jtu_FhvABlToti5ycGpR4XsE8HuOF0NhvPABHvNG8 | 952 |
| ase/gui/defaults.py | sha256=ug0dCFJmtgaBPPP1mQW3aewqzyzjChwIPqh9SnRmDL4 | 1152 |
| ase/gui/graphs.py | sha256=g3N45T7usLOt-11Q4UetB5RfRD-YRI-u_qPqNa3biH8 | 2991 |
| ase/gui/gui.py | sha256=9GMna-wje5VrHSU91uXUtJcWF_KidTG2SK_xgQF19hg | 23558 |
| ase/gui/i18n.py | sha256=h4agW39F_PVYia26bEb1tpZK1r5b8eUVO84XGUdOArE | 1079 |
| ase/gui/images.py | sha256=G9YSGZw-FRGj-o9rwbuXr2Swjh3S_sjb1XQn7Hl-t5I | 14949 |
| ase/gui/modify.py | sha256=wXaiMkawh3A59f_FKOnRhyMgEp2kArlcXF0caQ9J4_A | 1935 |
| ase/gui/movie.py | sha256=Vum4c0_4G-5ViYD7kbyU2JR0njpwL4hahxgr9Y84oTI | 2984 |
| ase/gui/nanoparticle.py | sha256=56eSVVolq0LfjnlRs4v5ZYcCc6ePwjzHKNLXEryjY9g | 19679 |
| ase/gui/nanotube.py | sha256=RrrA_6AFX0PZz3U3relaZi_UiPeFS4zIZjM9AT6b5Ys | 2844 |
| ase/gui/pipe.py | sha256=z02UKMzV6RwVIRVkuDYsIkB2WdQbuzG9gUoKr9XhZ-M | 702 |
| ase/gui/quickinfo.py | sha256=Ip5IhzMscFBlInXFPY7jmacGhU5_uUI4cIN1X0jL0kQ | 4396 |
| ase/gui/render.py | sha256=kom_ubcR_w8vWdL93Hkel3_2_tHU3uHSibwiFMt7fkU | 7632 |
| ase/gui/repeat.py | sha256=41gZUlDY4QlXwNilTnFe3rvVM25vJdC9Q-NMCq7VsoQ | 828 |
| ase/gui/rotate.py | sha256=qOzL6CfDFseUs6eXcp8Bk-IwZhISALWjGkznfC6dVTg | 926 |
| ase/gui/save.py | sha256=lz8R2IKKn4C54aBTb0FMUPC4Atz0Y88A9e19JF9g0WQ | 2613 |
| ase/gui/settings.py | sha256=64MIxr8jfyufOSGEG5nhVJ2guJKCbT_RcyXQ7d1IGBQ | 2834 |
| ase/gui/status.py | sha256=498a3U8t5lKtolzBTT964H-k1RxnJsJk2l8OXISzPzI | 3321 |
| ase/gui/surfaceslab.py | sha256=axx6RhKsdybp1xVq8j74jW_JTvpDfts-ObvNRJWflX4 | 9385 |
| ase/gui/ui.py | sha256=dkKGI-_qGs3vhVbTRj0d9xmKSbERL2LQ76rHZaAEgOk | 20050 |
| ase/gui/utils.py | sha256=tqDN8CBxWciOfW3AYcRUyqtAiRguaB8NyjLFankFQTo | 219 |
| ase/gui/view.py | sha256=6X5s89Y8zhZd4ptetK87rBW9viijX0azf7xS1-wRmBc | 23326 |
| ase/gui/widgets.py | sha256=yDStU6H6JErnGKv8Zf-zNcDxINMXJO9JfY3u13WiM4A | 2380 |
| ase/gui/po/da/LC_MESSAGES/ag.mo | sha256=mNMc_2M8K_oT74dGYAkM4gbaCPzQPOKeOp8YPskv-F8 | 25962 |
| ase/gui/po/de/LC_MESSAGES/ag.mo | sha256=yn8nnNMMKNgiDRy97lTZM18_EYQob8tdpW0gzSkVzOU | 22595 |
| ase/gui/po/en_GB/LC_MESSAGES/ag.mo | sha256=zeWSLLix-Lc-_n5T7cWdT0zpeTfHldi_CG4EAQAP_Ns | 25604 |
| ase/gui/po/es/LC_MESSAGES/ag.mo | sha256=tKxLetM-cSL8NVq-fmkvnb0RYuhXH-uXOfMpJznFW6s | 27214 |
| ase/gui/po/eu/LC_MESSAGES/ag.mo | sha256=kTd7oU8XHboiKDRZJ_zmTo1REKha2bMmQEzmSJHxUYI | 27156 |
| ase/gui/po/fi/LC_MESSAGES/ag.mo | sha256=SorOaOgLg-MJoMdzna5a8WNMtCyfBWNLo738nzwJYtA | 22904 |
| ase/gui/po/fr/LC_MESSAGES/ag.mo | sha256=iUhtLPZWg1eaUohrTKGMGKoDkTJZTL47UE3NxYRyVJw | 30059 |
| ase/gui/po/gl/LC_MESSAGES/ag.mo | sha256=Z9W5aReROqOR1fCRONCl-wIf4VLPFPYrcu_F03FOaOc | 26818 |
| ase/gui/po/ru/LC_MESSAGES/ag.mo | sha256=JJkDw2lWfw7OmIb6CFm5gz_ZG24prrSYRh89l1CRQ9g | 33742 |
| ase/gui/po/zh_CN/LC_MESSAGES/ag.mo | sha256=wK5cBPuI2gbaWyKu9sWotBI5l8LW80_gtRWC2tU2PPU | 24126 |
| ase/io/__init__.py | sha256=s1XaNRKkpfZtfTNgKaLmUnh9z95TzOwmvVQ0pixYfYs | 442 |
| ase/io/abinit.py | sha256=1R8g1kyb1fxJIoTa_pEpWNP7X7iR5OTrw-jXlK1h2wk | 23933 |
| ase/io/acemolecule.py | sha256=F5e5Gf5UI9UT7XStXozZvZl8QZ5wa-7FEKput5Ee-oI | 3986 |
| ase/io/aff.py | sha256=KZ72657oorOC3bmRH0jn1Nn0_9uccvbma1buQ1YdYQY | 246 |
| ase/io/aims.py | sha256=I3KdGF7D2HdKieIcB67l9NNMY5tWxQUPzdwnYtvw_aU | 21022 |
| ase/io/animation.py | sha256=vDsR3eo6r3LtFlJFjIA-fBW2vh8omU7nQ1l_Od1xAaY | 693 |
| ase/io/bader.py | sha256=rKoGqLD8LxrKlfnc8GP1Lte4HEDa7aeRkPZMUTJcW4M | 2026 |
| ase/io/bundlemanipulate.py | sha256=C0oof1jqQHn8-2t20gGWS-KPGnxyGSznifdsTFUku5c | 7574 |
| ase/io/bundletrajectory.py | sha256=C8TAUc352z8KTMKgLwLdp-odWq8ZdmQm4Iyal6YDsDY | 38554 |
| ase/io/bytes.py | sha256=YA7JCH7k4_x0yAZgKO3r0U1f-_vmxtVTZ7bdEgvPTUc | 776 |
| ase/io/castep.py | sha256=bt8upyWv2hxuHOrAEFnsXrNTpAPsyFu-iwwwrQpqzRk | 50215 |
| ase/io/cfg.py | sha256=jhPQmqLzL6suY1VR9PlcceD2lzARyR-3bShPg3oA9T4 | 8411 |
| ase/io/cif.py | sha256=s1wNtpxZ83DATDrZZZz5fDV1Bvb7ajXTOl_XcKXQj_k | 28996 |
| ase/io/cif_unicode.py | sha256=3t6UUTcCBPqhUYkUGC30_WH9HxALBOK3GzXoAMqe2Ys | 14005 |
| ase/io/cmdft.py | sha256=nBawXbihZ5uWUJToGlTnz0j2ULSciniQjG-SvGwQynE | 499 |
| ase/io/cml.py | sha256=m1gT4ZP1ozXf60w5LfBa6KnOLsWdW6KEq2nVa8gqCsM | 1165 |
| ase/io/cp2k.py | sha256=-Yr--Uiics1dXAIcWNSMKYyR__NnvhzzzEidyClqqDE | 10706 |
| ase/io/crystal.py | sha256=9n8iY2mu8c0hMOXjm_PjpYi6h05Pm5tTZF1DFXGbQjI | 3342 |
| ase/io/cube.py | sha256=Ir9Inoz1fKRPrAVfA2YfvkEusKOJL1hR6Ql5v5K8gEE | 5383 |
| ase/io/dacapo.py | sha256=5alHdtgfwEg337CDgEDkqkPYBvZ8KVUobY3bQlQYZGU | 1444 |
| ase/io/db.py | sha256=sq0Uf0Cc9UjSNj43tbwoLF16fB5Xlg7XyQezLz92Xjo | 1060 |
| ase/io/dftb.py | sha256=kdp3FAEvr_XMPw4e9LDUiNv_xm1QBPYopSqeXGr2Cdc | 6366 |
| ase/io/dlp4.py | sha256=cCCPCLvVqPI2mhZqx0h12z5hqPqEfdPoLbK5n0dD8_M | 8635 |
| ase/io/dmol.py | sha256=RT3ga3nRMmHz0Jn_sgwS1NdIY192vIIrQchaNkwHvkk | 9387 |
| ase/io/elk.py | sha256=jKw4GIsl9u8Y_TN7Ag0Mnd0Lmj8mC0uPAB8wE9Vzn9w | 11899 |
| ase/io/eon.py | sha256=q2MTG-LOPYEIkSiHkQEmlfvm__FDn7NaDQtZxaY_xIY | 5078 |
| ase/io/eps.py | sha256=0bFpQNV2cN0WLOKdg4V4YP27D7B_bSjTL97WyizdabY | 2226 |
| ase/io/espresso.py | sha256=JYQ1AO5EbZWEAGNbIeonMw18BNDWyuU5NqL8ZwrYB2g | 69265 |
| ase/io/exciting.py | sha256=dr_JxccEB2QH7ZrMmVXdcxKooBKrNb_iz9vqLyZiyIA | 4807 |
| ase/io/extxyz.py | sha256=-5sRFHs6nvdBVS70WOKUICW_uo5QMnTfI1v4AkoPokM | 37441 |
| ase/io/findsym.py | sha256=5O-hGXEfSC4rSL9pSNdnGfa0grU21iDXN6ukrnkokLk | 991 |
| ase/io/formats.py | sha256=8Qku9y9lf0YMLIuWlT-2GydqEJaiOTFfskFapJ7oFGY | 31950 |
| ase/io/fortranfile.py | sha256=kgZMG4UgpFS-BGUEFTsFjfDVII-vIS7h11NTCk9uKZ8 | 8165 |
| ase/io/gamess_us.py | sha256=a2lRGY6WTVzlMF-p17cdsSQWVROQtvlfphXPDNkXwBY | 8680 |
| ase/io/gaussian.py | sha256=KyvIpJYbZ0NpN108hjwR05bPl8nNKux8rzWp_FjjY0A | 50410 |
| ase/io/gen.py | sha256=84W9YV0XYGJGoX-QsbL5ZaIN4F9ci2df9eRttWZSw58 | 4739 |
| ase/io/gpaw_out.py | sha256=967MAEHVg0vZFYmOLgERi7en7PAi9vuNnWs65Hw9VfM | 7933 |
| ase/io/gpumd.py | sha256=MG9Go4sW5Fmh-CxSKQrpmE5oiDBE7ZuS7LOcdyHnYdo | 9762 |
| ase/io/gpw.py | sha256=8o60rBxtUyslCH9HdOF9UYWQNAjmLJnDRWKO9TtTEvQ | 3021 |
| ase/io/gromacs.py | sha256=9z82z_UAyb1MuEJkGHh_T1nekxGjUxmXdlDkOgdJr7I | 6737 |
| ase/io/gromos.py | sha256=xIfVp4cqN3n7zsZVOyENHrH_T_XTRkVQ-YBv9vs8Cl0 | 3874 |
| ase/io/jsonio.py | sha256=FROh6XM_dFUm6DWqiHC_dbSGUjStisg0kEhPJziaS5Q | 4700 |
| ase/io/jsv.py | sha256=1JdlqMmPaSCUk6Ia6PdfLdXpsx9YiVe1Byjmm4h2nRw | 4751 |
| ase/io/lammpsdata.py | sha256=Yj2cix1-TrneZGOliJM3FFrRQI7b7M7JikU49OxbeBU | 19056 |
| ase/io/lammpsrun.py | sha256=xK7BnUYt3GQ4SZDm9g9fhoK28_8ndbsZZkK-o9yh3iA | 16741 |
| ase/io/magres.py | sha256=zL1bXOB8vNFi3dUGANg3Ksdt-vR_3PkSBnBxqa4tKfA | 20393 |
| ase/io/mol.py | sha256=8IV_bN8wzhQyWcLdtHhLc8If3QYL7Hfb12J-cgDJTBE | 786 |
| ase/io/mustem.py | sha256=8lT4F9ze97T07GzxuKoIrJPxLwpTqbksvM6QIwzHDIg | 9822 |
| ase/io/netcdftrajectory.py | sha256=HMf0uOtPLgy1UplxqbfmkhJe1CAioVd0-9THoyv2VT8 | 25777 |
| ase/io/nomad_json.py | sha256=rA4N0KAHEIxEO8amFyW4yhQ4BHfhKXCd0jyYH8q0Uew | 334 |
| ase/io/opls.py | sha256=gxFTgK5xWMoxzT50JLQgqTJhwLnXDQe_3g1JkV3-yFY | 26673 |
| ase/io/orca.py | sha256=GLpXNHBIjY5nlEw3Y-qa8dRs3cs32yNp0b8FpO7HbT0 | 1948 |
| ase/io/pickletrajectory.py | sha256=YQ__yLcJ7st33BPmbZDKHtMFAduzpOXhVrZnCiQzFjc | 15725 |
| ase/io/png.py | sha256=RCg0uThNZrlliUFJdak14lNkQBBHx0qikXGc22w3QzQ | 900 |
| ase/io/pov.py | sha256=bEhsa5Jy5ahA44z4yYaSNktcSzbQmm8xFnUonBNAQk8 | 31307 |
| ase/io/prismatic.py | sha256=Ce7_s6A6rM8aCHTuyh_ivYeywh0hCtEf-LPXn3Vm-hM | 6159 |
| ase/io/proteindatabank.py | sha256=ul8AOcpleTDQQU-GW0bvswLcjMv1-evOWUai-WIffMI | 7686 |
| ase/io/py.py | sha256=RsHbNUp5htzI1U2VZCIFbQS4lkjvdluPX9MEjnbr-Vs | 1232 |
| ase/io/qbox.py | sha256=J4qwObeIFoWs7VSZAmc6SNag4o304780co6A5RaLxys | 6790 |
| ase/io/res.py | sha256=HBzkZNNYLFtEHjJBKTaF8xVFg7z-7pIokUUNJwYr2Yo | 10269 |
| ase/io/rmc6f.py | sha256=sy774A5oTxk7Wgkr91hWgJYC8dmNFBHBOKzKNOfLclo | 15743 |
| ase/io/sdf.py | sha256=9vu7w0zJ7gg06KWMsSkRewxB9g8efIAHkCrW1H7MZrc | 608 |
| ase/io/siesta.py | sha256=kThsNx0SDfAk9BMnYP3mHXixPxus4bLs8iv2c0AgcU4 | 7479 |
| ase/io/sys.py | sha256=qDWo-jF3o-jojeIpXQPEYzYKT_JQpKucUH8qbTYI3EQ | 2140 |
| ase/io/trajectory.py | sha256=MlwnwzOjSR9PtE8a4xU2vLHL8IUA6y6r3LbVCCxUvcw | 15703 |
| ase/io/turbomole.py | sha256=3nRudWXH_2psK6Fpb1QXT0cWJCoe_sAZqfg-KIZofWc | 5881 |
| ase/io/ulm.py | sha256=G3sTDYTAbQI3a8OB0IuaUO0hEQKmfrylzl8eQGanZ-I | 20725 |
| ase/io/utils.py | sha256=Lx0Z4FMB_YmwO5EockPFA43P042N1MDi7gsDh_WH6-8 | 10644 |
| ase/io/v_sim.py | sha256=cq6KJY7jlXBSAd47est5nViyShCtr43HFBM0ElRK0qw | 3875 |
| ase/io/vasp.py | sha256=oIY5V5yv3RtWudBGn8-ZdatTjTDCrPrd_fqyE96D-0U | 28108 |
| ase/io/vtkxml.py | sha256=qplqo0iGhiaZJYVX0OEN2F4mjUz1K0DHlpplKebOYR8 | 4157 |
| ase/io/wannier90.py | sha256=4mejm8-U2kHkoOiuHYvgHvD4OcTOoJ4wnJ_sfW9-zoY | 2166 |
| ase/io/wien2k.py | sha256=mLLHTbjZ_m2BEffKVF9OF5XMstXdWvnC5PlQHnn-xAs | 6089 |
| ase/io/x3d.py | sha256=6TKJJpY3zi9-wwPqHW3rlfLWBc6nIu2GBCKIauxK0fo | 4024 |
| ase/io/xsd.py | sha256=1ZS1jEWVhpxWC3Fg6xVQ433xOnzbImCGRiPrgwS2ZPc | 14774 |
| ase/io/xsf.py | sha256=YRrfw8Ait33vc3KoZe_NAlqhxE6aTIL5sF5D3OjA7pw | 7909 |
| ase/io/xtd.py | sha256=IGLuI2z2c9-FYyqQWGOzy29vlyUBLBTVltcGQZgjs58 | 5860 |
| ase/io/xyz.py | sha256=hkNtaDog5UFPkYWbSaUuPstoFhCSgyoV3K0ybvSTvBo | 1691 |
| ase/io/zmatrix.py | sha256=zrPi_42ekv7w29wHjUf4h-1iOMBkp65pQiF0J8hXjAA | 9175 |
| ase/io/nwchem/__init__.py | sha256=0pKxwtnjkfj1YZCm9vk1GpscDpd2ehw_i89o0TLOZ2g | 184 |
| ase/io/nwchem/nwreader.py | sha256=mhhQ6Na837c8HuAFFVgJTtC59JWEiJ6Fx0djSWj_LzA | 23176 |
| ase/io/nwchem/nwreader_in.py | sha256=9QYUEbeofuQuFGcaoSUaus81WYm-J9dvniWK1M4KbRE | 4511 |
| ase/io/nwchem/nwwriter.py | sha256=ENrps3OLDbOiijixZXgpRM5-8p5p9ro79VZx76VuEDo | 10767 |
| ase/io/nwchem/parser.py | sha256=5thoS3grnlvhj5u9xHTZA3k6r2QbBw42JWepodrvPs8 | 255 |
| ase/io/octopus/__init__.py | sha256=Y4diV8QDNfYqAO1x_dFFhepomOFNWUZ2lngwbuumBjk | 1694 |
| ase/io/octopus/input.py | sha256=YD-9l251fOIbumfp5EmKj3zAhy8W9bjMjCyx6WzLvQA | 19620 |
| ase/io/octopus/output.py | sha256=W2GXb7kZXkrgK3pTmXv7z7h7QyFnHFFbKAsSnaU5pCU | 8218 |
| ase/io/vasp_parsers/__init__.py | sha256=FcVO2xHngIumj2_YUBkhUqWG2VvQmGrYO5S31Pt2zgo | 71 |
| ase/io/vasp_parsers/vasp_outcar_parsers.py | sha256=KpVHyYPiVLiTcC4XhINsvOYJm5utcmlSffL2FDpI7EQ | 27078 |
| ase/lattice/__init__.py | sha256=eFuVUakjOTzp0-FRJtMuP5yQiDp6h8ToS-awGlYqZFo | 52976 |
| ase/lattice/bravais.py | sha256=mhxGXz92B3pSGrpskHrhbjeFDcJ32Ikj70a5jMlnuIA | 19437 |
| ase/lattice/compounds.py | sha256=PFLZHk1B3FNOktZLNsA0QYWDpj0-WOnkZjeizZ0gZOg | 6939 |
| ase/lattice/cubic.py | sha256=6LsvuizkEjyjPYckJ-wASmklhYzTbWarok4xfR07f_Y | 4442 |
| ase/lattice/hexagonal.py | sha256=Af0QcLeQ_MbJ_RNAqDY1q5EWBC_00vC4IDEuS3iW25A | 4186 |
| ase/lattice/monoclinic.py | sha256=erS94KCCg__rvAA73zeRGxY8D1oxzkmXF4PP0C2Xj8E | 1635 |
| ase/lattice/orthorhombic.py | sha256=m7--za-H2MEtsxvAnXPqae-zyO_QpVtpGqeaADbhGmI | 5446 |
| ase/lattice/spacegroup.py | sha256=2AJMNeDDILkIotPhKsShJABf93hw0h_xt0xPcrdsMBw | 141 |
| ase/lattice/surface.py | sha256=6DGsiQO5vQYh4KGYfDZ-gqTXoqCgxAYHIrNCpdNt9rY | 765 |
| ase/lattice/tetragonal.py | sha256=maeIeuswL0-CKEN5wwL5hgtykvmO8nJOrUeVzoH7gdo | 1454 |
| ase/lattice/triclinic.py | sha256=dS4uUYdpe7FEr-Sa8ENrSPlgZSw98jOQ2ox5Wyn2jv4 | 3233 |
| ase/md/__init__.py | sha256=5gNKfCcNWbdT8Tw2pNJIfVPpu6kFteUkPQ_7bVpjUHA | 243 |
| ase/md/analysis.py | sha256=kxSprNljfote5hz5CDnymbOylxRozH0SfCqTq37-V9s | 14920 |
| ase/md/andersen.py | sha256=jf-oQR0Bd_i_zo2MYeJdYaUEI_rQyharkfsqyHejQ74 | 6003 |
| ase/md/contour_exploration.py | sha256=5TH38kvfaheQ39jkOvVF8lXT6trQTZSrmhseVV8GRIg | 18588 |
| ase/md/fix.py | sha256=H2GZ5sIfezCIWwerGbJHheyV7heIyxSLHS8a8TeHFNg | 1238 |
| ase/md/langevin.py | sha256=dC-I7HjwhCVON970Ozfs63UvbSgBo-YwQzjn0KqgeYI | 6941 |
| ase/md/logger.py | sha256=p7Rqa0XXXhGLCU0oFj32vPE9THNNyUCkzv4pJehgjjY | 2988 |
| ase/md/md.py | sha256=VSI_7P5apsTyNs41RyV1Fd3_aT1MPH64zOPOzXHQ1OE | 5519 |
| ase/md/npt.py | sha256=PpoEEXV5hMFJ12GPAmeLAENf1NDreCIb18hnIEjF8_4 | 27587 |
| ase/md/nptberendsen.py | sha256=oE-EjqJuHCI2_mKgKDh_v4zGYxY3-MBAyWur2xzRPvY | 11049 |
| ase/md/nvtberendsen.py | sha256=ah5mLw4nIq3i-_eg0XszZ_NILq_OMacXcF2OUbni0Yw | 4734 |
| ase/md/switch_langevin.py | sha256=W5BnrvLhazVgVTIqDkXtI_WVlQG04skyKeDIwB1QFIA | 3677 |
| ase/md/velocitydistribution.py | sha256=0kK7lKEvqkHgDyBiTwgcA8SUafk21zRuPVj1-NPydLs | 12877 |
| ase/md/verlet.py | sha256=EEhy3UjA0wDp7UEnUt1MjpymyzaPN1rkOSPwaUfOdP4 | 2768 |
| ase/optimize/__init__.py | sha256=QP1_WI1Zki5mLEFp2Hr9nhI1XJgAyEalr53TlM6_8Ok | 687 |
| ase/optimize/basin.py | sha256=crSPpLF2rB0bbljysdgmugXi9dQQNwa28uLdPxStbeU | 4609 |
| ase/optimize/berny.py | sha256=urr6akWJd5JFobK9_WacTyeFX8zvV0hGsvN3VJ2b20k | 3033 |
| ase/optimize/bfgs.py | sha256=XgfUd3Zqa1K2tbu92a-4cAzkKAZA2SgSkYVxjj_n5-U | 5493 |
| ase/optimize/bfgslinesearch.py | sha256=k3io3C06G9d4zX16zulz6thBtH9uD7gSgKXCppDGgRY | 8339 |
| ase/optimize/fire.py | sha256=ls56tJzI7WYYNhggstKtz5VlBw6DKe2UvwmqnvyP79Y | 5371 |
| ase/optimize/lbfgs.py | sha256=ebMvBfTYa9RdA9pInjqMBlLUnYelRuGBr4s66Un3occ | 11242 |
| ase/optimize/mdmin.py | sha256=DtraprUSZz9tnGQUB30I-0oK5pCXxSN8rhkqVDvY9p4 | 1811 |
| ase/optimize/minimahopping.py | sha256=LVPdDqP_-XCICjBkN5N-v3NDvfDxXnNWx_vS6Nhq4W8 | 29525 |
| ase/optimize/ode.py | sha256=23zD4DouLvRJ4KjKsiTdvSDYtfkR9mw6Db2lgdwDSvw | 7282 |
| ase/optimize/oldqn.py | sha256=n800PYGZL7f6pXgDxVXokisveRk697JY9niyRmKRW0g | 12488 |
| ase/optimize/optimize.py | sha256=e7a7W6c3maO5dwKM7npQoZ_gjemHlGZ9QXLHhTbw0L4 | 10534 |
| ase/optimize/sciopt.py | sha256=G24BKx3_iuxLPacjb7bIpuRMBEimSmcosHxIKs0MEZI | 11532 |
| ase/optimize/gpmin/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/optimize/gpmin/gp.py | sha256=m3Fd6IsokRlJ0eIttO4xe3BJwAkj6gyirST1g__SOlA | 7106 |
| ase/optimize/gpmin/gpmin.py | sha256=drCKAef_gkKIGQ_oehDrw2NN8eKk-wpEBl-jFicf9lw | 11340 |
| ase/optimize/gpmin/kernel.py | sha256=e_sQfwWe0VE6uKLYlQZRRTWiEt1ShfXc3C3JtkStjlk | 7228 |
| ase/optimize/gpmin/prior.py | sha256=ijEAI4ps3AdsTCka2pR_O59ylWbMIJnY2rcXfLxpl-o | 2302 |
| ase/optimize/precon/__init__.py | sha256=BiF1eMw82eEvym-LrKu6FhKuFJa_Sjqp23bPtuYL89M | 1739 |
| ase/optimize/precon/fire.py | sha256=HLEbiH4HtikAPCQx_YjbA812MkFMtl_bEOdEiumtqG4 | 6847 |
| ase/optimize/precon/lbfgs.py | sha256=UIdSy4Fx8f54iUFr7yTEAyImCVvpWq1uTJmmDRUbVLw | 15544 |
| ase/optimize/precon/neighbors.py | sha256=zITKFp1rRAhvf86n4PkpGlo1ZMmVGtsqYE-Gy25ASFY | 3850 |
| ase/optimize/precon/precon.py | sha256=7M6qAaXF69bbrDq0d7ryyU91GXNiYxLOs_YoFWEJyI8 | 51807 |
| ase/optimize/test/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/optimize/test/analyze.py | sha256=OpwOyD4DNPbVRIsU0YP-uqR1xhKAzZo24x2Fe5-nEO0 | 2021 |
| ase/optimize/test/generate_rst.py | sha256=93xKpkSsy4uy1JpRKIV7O09WNp34dsIrHrpZAhoJjwc | 1705 |
| ase/optimize/test/neb.py | sha256=0guhlzuH6rjtFkw06pA4bJx9H7fmdZGC8SsYIvMTKmI | 1078 |
| ase/optimize/test/systems.py | sha256=yl4jvDGjQBfNuGPvyvKxauP4D-VJQFAJhYY2cZLAN9U | 3844 |
| ase/optimize/test/test.py | sha256=hfHlAXCcnPhC6jnNgWyyhIBgmwlWZWhxDn9yEQ3ZB4I | 5562 |
| ase/spacegroup/__init__.py | sha256=D3kX55cLy4v6DeiJoZ5YmS_ZtNid4TmEfXpgqYH1gSk | 431 |
| ase/spacegroup/crystal_data.py | sha256=riI5WrKJzSK4wi29dQCFWASFvlKpDMC-sNQRWXbIuCY | 2832 |
| ase/spacegroup/spacegroup.dat | sha256=itOnH2V4OPUv9O8CASwsxlAtgtZh6jYc5fLuIGJpf-w | 204447 |
| ase/spacegroup/spacegroup.py | sha256=Ud1l77LQjt04fISdzVRG4xNthH8-bqciYqn3Ya9eYrA | 32329 |
| ase/spacegroup/symmetrize.py | sha256=V8XYoAl_iJv7E5Ic5y_EYBcBCgrT1juB1DP72WSeMjc | 10747 |
| ase/spacegroup/utils.py | sha256=PCOv2Q-gTATOVGOVWYl1kd_pvE9tUMKDLHByFftw4yw | 6686 |
| ase/spacegroup/xtal.py | sha256=7SCOPhN9TikRKDrTe5OjmAreLjTMyb6iXlrbfuJudVo | 7893 |
| ase/spectrum/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/spectrum/band_structure.py | sha256=HUB1QWuinHJeMVFr8YtoRRhWXGcd1CHjIweXz3SInoo | 12781 |
| ase/spectrum/doscollection.py | sha256=3SJzhqgvrhMglj6TXEw9TkpdXUldFBUzyHlcDtCwsx8 | 22466 |
| ase/spectrum/dosdata.py | sha256=oW5smBlFLVWH2yJRH8w-dWJjhaYd_RieLvQopVOCUhc | 19081 |
| ase/test/__init__.py | sha256=hGrnFPRfBAhr9Dc1YbG51K5FXpxMQ8dYaK7Qnwd9GXQ | 82 |
| ase/test/conftest.py | sha256=dleLfVJYg2-J4B3tUmPtDidvLndqOVEta7sSazR5zZU | 11570 |
| ase/test/factories.py | sha256=eJtveERVuh708ZjXHodjZpt41RLEYRGie9hDjDcjQDQ | 21917 |
| ase/test/pytest.ini | sha256=8Ntarm40nXCnAqg0GJ0Y9aupl6H1q0FNoqBRmpeLW6Y | 888 |
| ase/test/test_analysis.py | sha256=g1U4ZVaNyaeSpMgX39krWL4vjsdFnwOOr6kF_KPjv4w | 1972 |
| ase/test/test_bader.py | sha256=zhhE0v9B1t1c1uZlUbuK1uq_mUW5VTMSnCjqm8ZfSPA | 962 |
| ase/test/test_bandgap.py | sha256=3ZfXNII5MhjYCDIGI3E2MiZmCgRjj3ofh8c7Ghtxxpg | 2261 |
| ase/test/test_bandpath_kpts_axis.py | sha256=lwlPVV-nrZCRBMov215Ds5EmSwXQYe-bUhjKYLhn1Xc | 573 |
| ase/test/test_basin.py | sha256=bTIHi86F-UdGkmAd5Vh-2j5ge7DRA8Hq2iLy0Ph42-c | 1684 |
| ase/test/test_calc_outputs_big.py | sha256=96MGMpwOtjlGAN0ItTW8C5EYb24K1B_jvGKRUqrIC2o | 1005 |
| ase/test/test_calc_properties.py | sha256=L6ys9SfrVvWchhA4kjfeyxg0WvlCoUBIbr3Ge6x1lfM | 2309 |
| ase/test/test_calculator_equal.py | sha256=4jYBD90iXqxnXGbwZo1tFMOw9inKzEUMpSgoqUAUb14 | 2136 |
| ase/test/test_calculator_label.py | sha256=3WNevs77WtYZ1MtES6aUSbb27i_XNWVUX5jVRxOO_N8 | 704 |
| ase/test/test_checkpoint.py | sha256=QuYWE7mICDnQ9s7CGdwTCKYw-siIQbstWdwYVK1uXcA | 1786 |
| ase/test/test_cluster.py | sha256=2zCWfbw4_ZzlWBDOC7IRKKHRWjz5d3eun45m5H3opBU | 3044 |
| ase/test/test_cutoffs.py | sha256=Air_KoNxuWuTsFe9_1h0z5sSv0coV-_1qtdXKmQwKQ0 | 540 |
| ase/test/test_diffusion_coefficient.py | sha256=pDwQTwlqOU9NXQoDHW3m9B-VyGsVRZzzp2MJXgAUdxg | 1654 |
| ase/test/test_dimensionality.py | sha256=lQ7HXsfraT7KOxo_6QeAWC3KllHtFDFYhkUih2hDg1I | 3360 |
| ase/test/test_dimer.py | sha256=US2xWMb9910IAH0E8G4ZNZ0LReeHzDWwhf_SNyg9m1Q | 649 |
| ase/test/test_dimer_method.py | sha256=kKpAOVNhza711INnKkF_li09526SsFf7CE2Yj0NuTmg | 1502 |
| ase/test/test_distance.py | sha256=c2tsP4YhXVKenl4DZQEn1zZ7A2O5QYqJJv7EYoDWwMU | 1856 |
| ase/test/test_distmom.py | sha256=fCC9Fn9bVI1qDPjA0EdSOtiGgShttZkqwIBn9-U4Dsw | 747 |
| ase/test/test_doctests.py | sha256=2mjyInZYsXksWNdRpVsi4w_ifb3RgQNGV6oDTDbMWrw | 699 |
| ase/test/test_dos.py | sha256=yE-1X3ccOscv8kGAmaPiDy0UUIdQU9VSEJr1eiXYSxk | 1508 |
| ase/test/test_eam.py | sha256=2nHFijkVgfshOPUm3zzgmJXUtFX3zL7JaICGbfO-iSI | 3270 |
| ase/test/test_eam_run.py | sha256=PZJjuyOcDOWO4DpWT-LJ1MhYe2G3zK4BaJDZYbRFSbs | 482 |
| ase/test/test_eos.py | sha256=tLXHqR8IkgAclaUCWLaZ2xxSoIJhWMctgf3s2l0Tlzg | 1072 |
| ase/test/test_example.py | sha256=De_tjVp5sSw2O9UUKLfFEQ6mdL5AzrAvUnW7DcmV6BM | 918 |
| ase/test/test_external_viewer.py | sha256=aUtaX_JSplP7GYRKzqEedrgPK8Dipe82KS1WUYEqSAE | 2060 |
| ase/test/test_filecache.py | sha256=g7gBcEDToI0Q_2OXBtrE1XGrD7VLKvJASpLHDXJn8Mw | 1807 |
| ase/test/test_forcecurve.py | sha256=lTB7d2XbDOzIdLiBLXcMpFcmeXe1RR2FsERv-dH5GsA | 561 |
| ase/test/test_formula.py | sha256=O3oj8aTOfyC_7bYw4JTZfIh3ICTaJi-BKEnVOr_opu4 | 2040 |
| ase/test/test_geometry.py | sha256=9MZgQADoAS5pr1F_HFch2XRZk7J4lIRzxeBvU6XKwrI | 8007 |
| ase/test/test_geometry_derivatives.py | sha256=ZUYhHtnsFPWQnFOCqo2D9ihROSHfMlEvVhFqsGmkvVc | 4136 |
| ase/test/test_hcp.py | sha256=ckoVNk6oW9knJ8gnGMUyVdKBmr79ML5U0HeUTSau3yA | 2159 |
| ase/test/test_imports.py | sha256=FTWxIw4Y34XeH48btli_0xgSJ8nxY-pHGOIcHRMqWI0 | 2054 |
| ase/test/test_isotopes.py | sha256=rhIMVWlOGE1w9cpH8IdT7kHJJHlScWW2SqpMDU7AzEQ | 1530 |
| ase/test/test_issue276.py | sha256=n_dQBUf2uL3B9plrbmZNFUhsuDTsbJ4GI4gxIIJVEqM | 771 |
| ase/test/test_kpts.py | sha256=Rdfx6vjNi01cY3hznEwpU8-syxD25E90snGmSVal7YY | 124 |
| ase/test/test_kpts2kpts.py | sha256=Fn36qIWDko574t8MAMSlBxmmxmn0oo9CLvqdQx5BMvE | 1098 |
| ase/test/test_lattice_lindep.py | sha256=W-c0nbOtCU1u-AHR6V5VuuBSYsJPrEiOce3vKE5QMmw | 2427 |
| ase/test/test_linesearch_maxstep.py | sha256=_Mqm6Ch7H1QPaIgIRRwhtZr78w0ZZcOfIfSVSn04xTI | 2063 |
| ase/test/test_lock.py | sha256=mBaphwLhZRjFVzFkXYA-Gn2vhn_Wi0s4p5StnY2xZKg | 686 |
| ase/test/test_loggingcalc.py | sha256=s6_eu4jlKLc_7N9aBNynCe__EPa49C7u12G7kSZPjSE | 551 |
| ase/test/test_makebandpath.py | sha256=jIhYennZC1X0MkcPFqikDgG39MegKpHcF7IAfN3AZL8 | 452 |
| ase/test/test_matplotlib_plot.py | sha256=eBmWwaSK20iJLuFO09DcT8Qv3NDQ_Uhu5MJG9IzRfDg | 1618 |
| ase/test/test_minimum_image_convention.py | sha256=WXdtQi1F7tJp9qp-7xAz_MMy2SWwcwmLQYONi-nCNNo | 2175 |
| ase/test/test_mixingcalc.py | sha256=VyXoJKcMfK29970VzN1xn7LQN8ejhHmy7_bjNxum7rY | 2487 |
| ase/test/test_mpi.py | sha256=O6kaQFTjfrFZ7Uacl7R-7IDshbgjWrGqyVEUgk2LaB0 | 662 |
| ase/test/test_noncollinear.py | sha256=gPe6H8qf8TZ06fOgLLO-4id5_n6aW_5KfJbNKPRvoeM | 685 |
| ase/test/test_nwchem_writer.py | sha256=tRZButN8hMDgwFyTE7nwFwFi7TPmGe1kxZu-xWxHPNc | 1882 |
| ase/test/test_parsemath.py | sha256=K8yZAz5NbCbJyw3MSGgcj4y81iO3x6rGt8eSavZDUHo | 3522 |
| ase/test/test_pathlib_support.py | sha256=Q3y6_RQhQZw6paI_fmJWhGObhKNJhtMG0wwI57YW31c | 1903 |
| ase/test/test_phasediagram.py | sha256=qqUNcgwRQ1bCm4WOCL9jDSzF46shYziAzPm0yYQM6ic | 479 |
| ase/test/test_potential_energies.py | sha256=XQWzWv3iaEpikkUVwAxTEeEEBGd5rc_gTVBXqa-jwVA | 666 |
| ase/test/test_pourbaix.py | sha256=CsfFUBf_IrcVTw5dxOXzO1C1qptomNsst85m9TCLhWU | 842 |
| ase/test/test_properties.py | sha256=eVXTqwFl1CuaHVTi9AcYeKTQol8igVag4Bd-TC2KszE | 559 |
| ase/test/test_pubchem.py | sha256=W0djD3d8if3nZ4l4d9km5tUPNdVl8leZzQ5hoJCaIVk | 1187 |
| ase/test/test_quaternions.py | sha256=xuR80O6P5PrbUz965sgidIvPUrCAXE5HDz-bRqXLlq4 | 3747 |
| ase/test/test_root_surf.py | sha256=pGdxsw4RT_YS-96wxneT16yZI6_EO4M4TKFcU3e2Bl4 | 1294 |
| ase/test/test_s22.py | sha256=aF4wJdau6KS75M2hrzgpRaoP6NrUJOMEZLKAWx3JSDo | 213 |
| ase/test/test_singlepoint_dft_calc.py | sha256=NtmTdgc6VKAKyovCBetda6Qd7W50dkfeoInJ8PHldY0 | 969 |
| ase/test/test_singlepointcalc.py | sha256=UBInO1Gfw2ODyrbA-e85jHyqmk-CrnAHNEvCrDFgZdg | 1500 |
| ase/test/test_springcalc.py | sha256=SMyoeVRYbsRcUGV72HI0bQOS7Pv0I8MpYM1vRFwgOpA | 929 |
| ase/test/test_stm.py | sha256=YwWKzgcufvy_SBomhG9DnjuVsVUmC0m1nLF-ulsgDQ8 | 795 |
| ase/test/test_stress.py | sha256=k2AI1A8sDVhhKW9wmy9hovDyseB40WEfR1o4qKkDAd8 | 2175 |
| ase/test/test_structure_comparator.py | sha256=Pu6y1OyhAVqq541P4eyMbbnVIdvD-G0VAhJmlumP8Bg | 10012 |
| ase/test/test_symbols.py | sha256=bEAsCLBp7OY8YQYZSkx3u6y7wUgnHhLzXB18hXMpzVo | 1992 |
| ase/test/test_thermochemistry.py | sha256=sDvncEXjKcCULNEYAVVGIvGWdZaIRE4rVUanuMcJhFk | 4315 |
| ase/test/test_things.py | sha256=1_QCs3Rt383uZol_-sNIy0QDn9vRDC8feRLGGolIpL8 | 636 |
| ase/test/test_timing.py | sha256=1JGSGKagEJ3XfzPqm_tEETDeuimue5S_rUYqpT7mLpM | 475 |
| ase/test/test_units.py | sha256=3YQQ7bS67QFuw9c4DLmXdxQsTEzsro_mamnq7bQ4HRQ | 2105 |
| ase/test/test_util.py | sha256=w2Ran-DLDxfhZFzjz9tzUrk-IvavO5iM68FaqYKlok8 | 817 |
| ase/test/test_wannier.py | sha256=dfRD9havnjo7h4Bwc2WjVU_K1oXTPUZ5ZWGoJ8sAZE0 | 16081 |
| ase/test/test_x3d.py | sha256=JFGwEMUSD3oNCmEBF1MwSetlPBk49FYlL7GGfMmZ5MM | 270 |
| ase/test/test_xrdebye.py | sha256=5SDiBW0uab70dNcwpItb0rmMKd6fWAuk-_TJ55nh6M0 | 1554 |
| ase/test/test_xwopen.py | sha256=bsKwkPe-1QduzH9IMAbR18oH5B88FJSvJAIFnU--oco | 654 |
| ase/test/test_zmatrix.py | sha256=I_VFRlcwVBKKwRa-UQ80C9BVmldTihOF12zkrkI8B88 | 2274 |
| ase/test/testsuite.py | sha256=ZgUGbOSrYH39rjdf9Hi1bdFslPwyipd3OnmrFFxsNM8 | 7000 |
| ase/test/utils.py | sha256=_kvBL9IaKFB7Z10ZwtM9zqnQjLQ06UXXvw9lCfK85Tw | 306 |
| ase/test/atoms/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/atoms/test_atom.py | sha256=YMW1Jng5L2ggYtnX4v39emaimWKAzTP5-uX9F-Mnr2w | 847 |
| ase/test/atoms/test_atom_scaled_pos.py | sha256=TNvQqT25abPesiqg8SPTWfOKzxX4nbmvLB3uuG5G_5c | 1247 |
| ase/test/atoms/test_atoms.py | sha256=k3PGXz2Wmdoty7k0xHCzUNphwsWrAL3rvxj_89SQ8AY | 1497 |
| ase/test/atoms/test_atoms_angle.py | sha256=ysQuUrQ9JYZZeogZ9-weMxekAL3-HLQM_X2E0YQkXJw | 1655 |
| ase/test/atoms/test_atoms_distance.py | sha256=52AZHc7q4zoDNDbqmLtJNskpJ3BemjXE2Hp4hb4fPIs | 2331 |
| ase/test/atoms/test_atoms_formula.py | sha256=GsYBH9fQU6KLZSR90j2dx8Jah4RIzzThZof_9JRMu7c | 1390 |
| ase/test/atoms/test_atoms_get_duplicates.py | sha256=jkKN2PmmNI1u0tLz5I57eZn_sjZybr5o260gGl5Jz4Q | 907 |
| ase/test/atoms/test_atoms_get_positions.py | sha256=Y0CZDrI4v3mE7D1GSIe0CWvNbW7rKsAlyKKG5lf7Arg | 569 |
| ase/test/atoms/test_atoms_getitem.py | sha256=aT14U8ZqhZnIKWTYot2rr49tn93dBBGNlZf_Au8dy5g | 425 |
| ase/test/atoms/test_atoms_info_copy.py | sha256=dbMjOzjJMoJHZWaZryxyEHtcYN-v-8LtOihuuoGLNGI | 259 |
| ase/test/atoms/test_atoms_instantiation.py | sha256=QEwh2ZNdgk9xSnmYatLUHOOWXmyK03oG_eME7qD_nxw | 1373 |
| ase/test/atoms/test_build.py | sha256=-e9Bo3y8bya554iMbQjoR8xC_dRaOH4zpRAa5X0woyo | 621 |
| ase/test/atoms/test_center.py | sha256=7LqpXQZm3YBovSkm0a8AyNdIv4b0FRUac9OXOPn0JcY | 3232 |
| ase/test/atoms/test_center_nonperiodic.py | sha256=7dS--AkFxUZVKE58wKC-i1fUnz-wZsiqV_xT2GQx9gI | 761 |
| ase/test/atoms/test_compare_atoms.py | sha256=mK78H57dTxVyZHUrmifw5jxSVKQeu4Vwb1Nn00ahY5s | 2097 |
| ase/test/atoms/test_deprecated_get_set.py | sha256=IHXbBN-RpN-qf5Atc7hRIHx-7YxjIT84vndvtYG8Rec | 629 |
| ase/test/atoms/test_get_angles.py | sha256=kFO7vm6aoZMfAcr31iL4QTvSjcPnleySPmqzbgf_c8s | 420 |
| ase/test/atoms/test_h2.py | sha256=dYxIzwMS18poYFswC7GwK2Zm6FeRPz088OjfIREmtXg | 290 |
| ase/test/atoms/test_mic.py | sha256=WG99kjwBBn5QisGeCzatIXCzSHnr6gd1s2lZFTLUdaw | 5313 |
| ase/test/atoms/test_momenta_velocities.py | sha256=QidUlwcp8SZubR-l6--ICJCelDfqnL5G81TUniT60GQ | 1066 |
| ase/test/atoms/test_permute_axes.py | sha256=wxNp9ZmtNHFO9wACLY65ID_3HdJmLTOy9U1ekj3qTU4 | 1179 |
| ase/test/atoms/test_rotate.py | sha256=6hvWgG4iRjqoGf1HKk17OMN-qjRp6De0HzikZkLXTYc | 741 |
| ase/test/atoms/test_rotate_euler.py | sha256=Pj8K9cLJB1wK84ewUfxHIPIqK-u3rugDV_VQXl-XOPA | 387 |
| ase/test/atoms/test_scaled_positions.py | sha256=Ankl6sFkpdfatwkO5R-3FV_1fsOuAbVWjtInSslZfqM | 138 |
| ase/test/atoms/test_set_get_angle.py | sha256=QUX5-AWO6k30Butwfmxg_6792IuPsqqJIV2GFz5D85U | 476 |
| ase/test/bandstructure/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/bandstructure/test_bandpath.py | sha256=QRiwNKyvdKfOf0j2cEAzr_kQ5nH69d3FxYc-oWNk6Es | 1930 |
| ase/test/bandstructure/test_bandstructure.py | sha256=MbPi_L4RhXIVJiM_56wC81Q2U3d6SxInwBlzHeb_JPw | 1154 |
| ase/test/bandstructure/test_bandstructure_json.py | sha256=FgI40HxfOtzKI-HvYF_2v5m6spoyCek393gUrKKdG8E | 707 |
| ase/test/bandstructure/test_bandstructure_many.py | sha256=_IK8eKTF6hslaG_yMVezWbz4Vq2OECHkvrxNKL5k_Ws | 863 |
| ase/test/bandstructure/test_bandstructure_transform_mcl.py | sha256=bnr-s7jdaoRIoGDMWkAwIsMbOYVFSkxlEZY0TJgqk0Y | 1485 |
| ase/test/bandstructure/test_resolve_custom_kpoints.py | sha256=FdeQIttJlFQXJ8vGJOOGDycZHKdF9OiBNJnGqefCwKs | 1028 |
| ase/test/bravais/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/bravais/test_2d_cell_pbc.py | sha256=Pnu7P0tu7yt3AApWJNHaRNgO8ZJgCYpegxOfBsFTBe0 | 755 |
| ase/test/bravais/test_classification_engine.py | sha256=uKgArG8QkxuitPVG_IJZfxLuWySutgsC7h3Ic8HYXT8 | 1093 |
| ase/test/bravais/test_eps.py | sha256=ecHLnqDOyCZF6EelKWiPQS15G93dNgDo-dFrvYyxZ7c | 1833 |
| ase/test/bravais/test_hex.py | sha256=_IkSPaZ0anj7TSOf4oK0mQQ-cR_5Sji2bp5jSzPtgmA | 437 |
| ase/test/bravais/test_lattices.py | sha256=nXJNgh7vmNI_mAmtvFmL_e2yJx1d5wqKC1WqHHh2fOc | 1384 |
| ase/test/bravais/test_line_lattice.py | sha256=gWIroWCSkuoN2fCGIcbD71AEWHH4ZTkJ9pH2DEPKym8 | 317 |
| ase/test/bravais/test_main.py | sha256=lWEOLrlOlhTfMg7Hke3dFJyZkScTgcbTxXz4jUzo6Aw | 4074 |
| ase/test/bravais/test_orcc_mcl.py | sha256=xYLNRVxSeP6xugPhqORwVLQjUEAdL8H_kf0nGaWFTGE | 1183 |
| ase/test/bravais/test_standard_form.py | sha256=VTqNYwm-UCVNEgKXRikSg3F-7VSj93qzsYhmMQSATnE | 1211 |
| ase/test/build_/__init__.py | sha256=LE21KWY6zOq7PHYK2ctJFM0EoZXvuNk4UTAF6IA-s9M | 99 |
| ase/test/build_/test_attach.py | sha256=gDzdjh_gKtWAsZAk1v-qrBOTvZSerNvsgbd0xT4jxh0 | 2638 |
| ase/test/build_/test_build_bulk.py | sha256=n15v9RdCXsvcbjOCPTUehkv5DKTbCRJyZVfC6Xs3uX0 | 1636 |
| ase/test/build_/test_bulk.py | sha256=BlARa22AxzN0-TTM_442aKaQRgms2NdbKVweFVHJwcc | 269 |
| ase/test/build_/test_connected.py | sha256=HXlSietzlY-aVxSvev4JDQ-pQVITWfCLV5HWnuWR37U | 1480 |
| ase/test/build_/test_surface.py | sha256=ciy-dPL3nxY84S7c-T6MxzcwxEfsM_93Tp_PvBsyNuM | 1536 |
| ase/test/build_/test_surface_stack.py | sha256=nShQo6zJYrDJpymotoJn1YaYhE6B_klprZ9jfMl_jF0 | 1157 |
| ase/test/build_/test_surface_terminations.py | sha256=cV-KT9EmWmszlpagmbXAAT_tv07EJWVkbs_rcYrEetc | 1312 |
| ase/test/calculator/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/calculator/conftest.py | sha256=IhZnPkjQ7mo6IVl_-cMGg6kNOz-4AFd0PVXuo-aD5fU | 106 |
| ase/test/calculator/test_al.py | sha256=VtxLAcVTVgbVFi6Glbbqwzko5yXzPgu6xCISq4Kqpf0 | 1489 |
| ase/test/calculator/test_bond_polarizability.py | sha256=FOf43WA7YQep_OQGW88gE7Q3_hdLo9mpuTRJvKtFZDU | 1159 |
| ase/test/calculator/test_calculator.py | sha256=VqJeHMo4QERoM2DKt7CzL2olDu0RZCmj8elEsfPPI-o | 2066 |
| ase/test/calculator/test_ch4_energy.py | sha256=ApyaxaTsGZsf-hfuLlqZw7FGJOPA4H0vAVbgC1nIsbE | 2413 |
| ase/test/calculator/test_dftd3.py | sha256=KLMyPhvnoQxY2z4ucAaHpC1H8vaqUf8-RltT8TuKDTA | 5893 |
| ase/test/calculator/test_gulp.py | sha256=O_pRSdNqsJ8gbr9nYAonEoqihuvMcmKvgLn5j9kwfrw | 2359 |
| ase/test/calculator/test_gulp_opt.py | sha256=55LE5OpMJwYH9CbuCWfPlMGs1eiU4u5bK72mMFlyk3Q | 1317 |
| ase/test/calculator/test_h2.py | sha256=Ww9oK-sW5Lq2lGjaC5n4kpQI72jyeaNRcZuJKfJb-CQ | 1618 |
| ase/test/calculator/test_h2_bond_force.py | sha256=lAWdzxFyWmopkDNwGSCiOdC8WRXEB7fKDSn8jmJDtLA | 1532 |
| ase/test/calculator/test_h2morse.py | sha256=FQIG7cI-Qf7dS5a2Kkx9pkXTdT833vE72RHFNeo2rBo | 2840 |
| ase/test/calculator/test_lj.py | sha256=LqdK0l5tPPamWjcPtwUYnI3CBcW4KSooIf79Q8MTpio | 3605 |
| ase/test/calculator/test_mopac.py | sha256=efhMz99ti6YngLq1lt_W4rX_6Y4Wxo_F6o1jV3bbb58 | 1114 |
| ase/test/calculator/test_morse.py | sha256=EVHyFk1GzDjAFPPicp6ZZ6HoPz6lcakv1GUoL6dXgxQ | 1191 |
| ase/test/calculator/test_orca.py | sha256=IKAFYHLrhfoz3KxJr-Pkbh_MDbBtOOuO7h-sKN248mA | 486 |
| ase/test/calculator/test_orca_qmmm.py | sha256=eEpJ4Cd4Jmt8rg0z_lI_qKmuewkaSOyuEIUPEwfj7rU | 701 |
| ase/test/calculator/test_polarizability.py | sha256=fwYVm9Z8boc_f7B1LRBDjIyzwBP9zFQxv5Mzu5QO7cA | 835 |
| ase/test/calculator/test_si_stress.py | sha256=BjEJ1JA1gzv5fsrYtZkDaWEAlCHAs8OEiSHlpgYLoMk | 945 |
| ase/test/calculator/test_traj.py | sha256=MvFqJgjnnZCWPUnhE7eAwC6rilN8fySOaubXjJi-oGU | 1462 |
| ase/test/calculator/test_ts09.py | sha256=1kyKGAHFWoDWRXKBRHEMH8eWjGed89cTmydwrhNBXNI | 1084 |
| ase/test/calculator/abinit/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/calculator/abinit/test_abinit_cmdline.py | sha256=32FzqzofWqgwIaf7OCvgK3ld1i2qIKiADpUP7O93a3o | 276 |
| ase/test/calculator/abinit/test_main.py | sha256=a6khsAcmZFFVeFltG1MhY9_LwpkwBxNIgNOU4vyr9vI | 2862 |
| ase/test/calculator/aims/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/calculator/aims/test_H2O_aims.py | sha256=SWRPXyoYyUUCBNceYfrAUyHjWxJmo67PRXkcnxGzZyQ | 794 |
| ase/test/calculator/aims/test_aims_interface.py | sha256=XB1_OS7eVUiPBNtRv3qSRCZHQDAWV7CG9pIKSbFg0EQ | 3877 |
| ase/test/calculator/aims/test_aims_parser.py | sha256=G7uixwmX7zhHtRsxfTslGxILAtlvCMdN6aeN3jFndGk | 73432 |
| ase/test/calculator/aims/test_version.py | sha256=0tdsQIN6z1_WvDQ5kanT84K8fHa07PQkMPkmm77L7fI | 292 |
| ase/test/calculator/amber/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/calculator/amber/test_amber.py | sha256=EIFBH-suhz3DkV-BKZXSbhjSh8KmgdptQxYhSnhSx8k | 1462 |
| ase/test/calculator/castep/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/calculator/castep/test_castep_interface.py | sha256=ZtcUhZIRWoDS9et4l9nDg9Gk_CpbbQh6b59Zj3G0rTM | 11266 |
| ase/test/calculator/cp2k/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/calculator/cp2k/test_cp2k_H2_None.py | sha256=V7XKXSthEP43hQMPOh9t_oCLOjuB-v4KBHRmjlW7uQk | 1378 |
| ase/test/calculator/cp2k/test_cp2k_dcd.py | sha256=QucQpO363LxiAWarEU5XOmjnjK0MPbFpcbwQnzzh0I8 | 2123 |
| ase/test/calculator/cp2k/test_cp2k_many.py | sha256=fAoh4MwY_DOBnQjCX1nDfPjDQ0fD1iz2mF05La4jhKo | 3686 |
| ase/test/calculator/cp2k/test_cp2k_restart.py | sha256=TSa2SyYECltBWtL4kAtm1qdJHs3Nh14LL6ZMTuO9jtg | 1134 |
| ase/test/calculator/cp2k/test_cp2k_stress.py | sha256=NoZooRJ5ZU5R6i8vW20RvEyTwHqad4eKUUD10TAxLJg | 2894 |
| ase/test/calculator/crystal/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/calculator/crystal/test_bulk.py | sha256=vWmWrRkZIQuwUpI1c9ApD3_QJfon9t03s6RoSkNB2Po | 1110 |
| ase/test/calculator/crystal/test_graphene.py | sha256=zzg-SJM0lKhAGrVO4UxPzR6EwHwAP9YvdJlhrbkaWwg | 1261 |
| ase/test/calculator/crystal/test_molecule.py | sha256=hWlZBVfSNVZ6GMUIIx7lTccj-p_POHVznxAogSVpSMo | 1024 |
| ase/test/calculator/demon/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/calculator/demon/test_h2o.py | sha256=SE6f9cKp4cALmihwLMiKrgX-htg9JXrBGnMAFy0cUMI | 2937 |
| ase/test/calculator/demon/test_h2o_xas_xes.py | sha256=EsPYlQxwTukSGpQ7rkokisEKqFcqmr26WGVlaISMvV8 | 4946 |
| ase/test/calculator/dftb/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/calculator/dftb/test_dftb_bandstructure.py | sha256=lLLSkoRt-9H3idL24mIgUTS6Ve_lLimuiTLztZ9EMFs | 1639 |
| ase/test/calculator/dftb/test_dftb_relax_bulk.py | sha256=QETzf0KHOCWjcBkYDK8p3WiIJsKhEHNZ4UD1-wtUi04 | 476 |
| ase/test/calculator/dftb/test_dftb_relax_dimer.py | sha256=uUe8Y1JDzLigVO6UtZeqrsVXy10c_GYnXIv_OwReX74 | 585 |
| ase/test/calculator/dftb/test_dftb_relax_surface.py | sha256=8_eQ2ExNE288hk_l3fy5dRDRZ_AN7mpLj2p3Dy-OksM | 822 |
| ase/test/calculator/dftb/test_dipole.py | sha256=YXWVkBEw4LgMvwcsW4Wigo9LlxJ8MFvF_ApyqFQQKvY | 335 |
| ase/test/calculator/dmol/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/calculator/dmol/test_Al_dmol.py | sha256=Yc9WNkSkWAKnM9AbrfiXpegEFfzthZ6u3Via6xlTieA | 215 |
| ase/test/calculator/dmol/test_water_dmol.py | sha256=77_lFok13Z2LxyjsPLE0soDWxO-PwMRVbz-1zVuWIOM | 227 |
| ase/test/calculator/elk/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/calculator/elk/test_elk.py | sha256=xAZxhX2-8d-yo4ZrXnxx8K0J1NERAEA-ful-YV_K-Dk | 1707 |
| ase/test/calculator/espresso/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/calculator/espresso/test_espresso.py | sha256=_BEQddKOvlNqXUPff0NQp9MjEgGkJDre0ScIde1ZBFg | 865 |
| ase/test/calculator/exciting/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/calculator/exciting/test_exciting.py | sha256=zUP_VjwvkEM1Wft_XMaO_7UfeLt0R5BE-7wA64Jp_f4 | 256 |
| ase/test/calculator/fleur/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/calculator/fleur/test_fleur_cmdline.py | sha256=VmToDkiNwplHb-VQ5Pm2eq0ZT3082I0zejgsM0xTxd8 | 132 |
| ase/test/calculator/gaussian/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/calculator/gaussian/test_gaussian_cmdline.py | sha256=kwkmVKNWyERjBwrduDUFvTM97o7Y0ADVkTdNlXsbRBo | 811 |
| ase/test/calculator/gaussian/test_h2of.py | sha256=CDC3YR0Ww18qCvGSLulpnv5x75SuK9erdqC-pJC8wUY | 2464 |
| ase/test/calculator/gaussian/test_optimizer_irc.py | sha256=3mm7HEMC2Q2b6ETHfjP7qGAHOAnNjJMyqGHJn2Xgn7w | 1903 |
| ase/test/calculator/gaussian/test_water.py | sha256=9ETodz0rVSEwFFmuZ-5RPhk6-qOJbGaYBU_9zWkhaSE | 1128 |
| ase/test/calculator/gpaw_/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/calculator/gpaw_/test_no_spin_and_spin.py | sha256=o39-qajiRCkI7wOnzfbqCssdCFDpI6Cuz4G2OosmYTw | 742 |
| ase/test/calculator/gpaw_/test_read_text_output.py | sha256=Zsw67KdhT-Y868DJ4FP7hptsPdaFigvN2HcqGCc5yUM | 1362 |
| ase/test/calculator/gromacs/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/calculator/gromacs/test_gromacs.py | sha256=Rhk12HUIX92D6wLw4TONIhDjgrRWYMZHB6HfYSHe994 | 2804 |
| ase/test/calculator/kim/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/calculator/kim/test_cutoff_skin.py | sha256=1pGYS_RYipxNKFnDZipXkD_MFSMzi1FlJ39RwoMkD0I | 2465 |
| ase/test/calculator/kim/test_energy_forces_stress.py | sha256=dVKpMJiQnTnHqvyc06DfOPGWWgVdgsZV9qQXsDQuUJY | 1604 |
| ase/test/calculator/kim/test_multi_neighlist.py | sha256=HExJEiLHFiuzRDAC8MeLwybic_MKFvP8-tFWzB6kQJw | 1592 |
| ase/test/calculator/kim/test_relax.py | sha256=G_WSC9XZ4Bhc8moP65UVOUQ1dURFg7HtJjKJt_fKrb8 | 847 |
| ase/test/calculator/kim/test_update_coords.py | sha256=icuwTLCvKhcD0h6-I8J-Bj1ZnZohspB0CbZupWegZRw | 4699 |
| ase/test/calculator/lammpslib/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/calculator/lammpslib/conftest.py | sha256=mKLQHV54X5cBDQlp482_Q4zruD0_0IVg280rqFzRaGU | 643 |
| ase/test/calculator/lammpslib/test_lammpslib_change_cell_bcs.py | sha256=DdFxu_hFjVpIBpQXqb25kfU8ro875hFZbUUyDnRigec | 1145 |
| ase/test/calculator/lammpslib/test_lammpslib_interface.py | sha256=QOlmxhPoddaQt4CL_VbcdDXcmXw1BI8FKJREQKWKRI8 | 292 |
| ase/test/calculator/lammpslib/test_lammpslib_neighlist_bug.py | sha256=9raGnjkcYolBuriXX-OVBTt0JSRXQDJwhNbec_9jeq4 | 1335 |
| ase/test/calculator/lammpslib/test_lammpslib_post_changebox_cmds.py | sha256=RUUQ-9HdjEcCiyXZCoc_s6FgmuSoePOsOCxJIOMvclI | 3932 |
| ase/test/calculator/lammpslib/test_lammpslib_simple.py | sha256=KPUPsFVhWoVu8tI7PGBqE0sLT9hs02c2y4D5LVg6d8w | 3921 |
| ase/test/calculator/lammpslib/test_lammpslib_small_nonperiodic.py | sha256=e0YIhY5qwWRh6B8WDvgZrQphXplyyCFzZYRabejPSuw | 980 |
| ase/test/calculator/lammpsrun/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/calculator/lammpsrun/test_Ar_minimize.py | sha256=tpibmm1TFHznjWLTq-Lam_qx3wJa9eHcphwc-uhtZHE | 2625 |
| ase/test/calculator/lammpsrun/test_NaCl_minimize.py | sha256=wK7CJzvSv9fggwQsjQ6lkWhOcQgVIbZrMCKkpSNcLbQ | 1742 |
| ase/test/calculator/lammpsrun/test_Pt_md_constraints_multistep.py | sha256=UcmeG_m0Kv821LN2iy6Mnrod-nR2I52gtxiCb7Da_WQ | 1817 |
| ase/test/calculator/lammpsrun/test_Pt_stress_cellopt.py | sha256=No0PAcNkfLnM5xVmc1bTpXZSKfWDmMwCdAtENKUa-qs | 1551 |
| ase/test/calculator/lammpsrun/test_no_data_file_wrap.py | sha256=cMAmuWMG8RWJqDs9tsTG435Mx63vW2ldBj3g0rKHrr8 | 1607 |
| ase/test/calculator/nwchem/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/calculator/nwchem/test_nwchem_bands.py | sha256=nXXtDiS53aCbybnDZFi7-L1kTsp0N4iy1PfzbfKVjUw | 373 |
| ase/test/calculator/nwchem/test_nwchem_broken_symmetry.py | sha256=Kw51D_kFTw3_WSoMj6S2IgebK1tfk_-hbmrW6yZYoAM | 1872 |
| ase/test/calculator/nwchem/test_nwchem_cmdline.py | sha256=eHwuxEOABGy1nKkD96Qnaj25bDBkNN03uYyvq2G2gRc | 973 |
| ase/test/calculator/nwchem/test_nwchem_eigenvalues.py | sha256=3UZqz8vLl3gwDe7RAgfiDmE4h6tj3YxTWc_EObqfBAM | 821 |
| ase/test/calculator/nwchem/test_nwchem_h3o2m.py | sha256=aW1wOgHnWRd-1Z09C2eV2TW5V9VX2tXOSOAog_elyYU | 2190 |
| ase/test/calculator/nwchem/test_nwchem_parser.py | sha256=jxOuShs5a2-iA3jkEL4gD4aH-uRPSNL__nfBC7cOCVk | 176 |
| ase/test/calculator/nwchem/test_nwchem_runmany.py | sha256=ounAF1zxuGbTt9EJ0-tcjzUaXQ2nOCB1oWmIOywnPb0 | 1630 |
| ase/test/calculator/nwchem/test_nwchem_spin_symmetry.py | sha256=KQQ57VrYOpsEafcqUddeEbhqf6Whm9Y81Ii3RNi0iD4 | 861 |
| ase/test/calculator/nwchem/test_nwchem_stress.py | sha256=KheRON5souIWXzrNiM1hykD2IoUyRwZoULpTmQ-_YDE | 495 |
| ase/test/calculator/octopus/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/calculator/octopus/test_big.py | sha256=hjYr_lMDeExC966klCKMF13iXo8x7uQDzNkIsm6ncn4 | 3260 |
| ase/test/calculator/onetep/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/calculator/onetep/test_onetep.py | sha256=8Q4rZa4NmM1_brtt5EECd7J0kNGiDEwJwXu1i6gx0FU | 997 |
| ase/test/calculator/qchem/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/calculator/qchem/test_qchem_calculator.py | sha256=wtFH1qnVzHvQ64PsOwDEspVZT_UNv22Wued_y48--fM | 1052 |
| ase/test/calculator/siesta/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/calculator/siesta/test_bands.py | sha256=32G_wdcC-2UtLaZx2MG504cBd6rXvjHTBcYl8L056uo | 338 |
| ase/test/calculator/siesta/test_fdf_io.py | sha256=F_gJKfDydnAn8yVDkKXGRB6OLG717kP0hP3ZOR1zuw8 | 475 |
| ase/test/calculator/siesta/test_siesta.py | sha256=hFWbJz-5fbO_2N4JMVSFzXzxGKv-_oFvg9bUhaRITJM | 3760 |
| ase/test/calculator/siesta/test_siesta_read_eigenvalues.py | sha256=fdqNd0Vhl-idPUYx9S8nxhfI9-rjvBy3NQIrjZmJy1I | 464 |
| ase/test/calculator/siesta/test_siesta_version.py | sha256=-fNowgRlOmnM-X9nstwzj7I8pYp-jLh_HjGv22bX2VI | 1060 |
| ase/test/calculator/siesta/test_siesta_zmat.py | sha256=29toVPNcRpciTegEncl-YMhizGmKKKDZVEtSkFD6Pug | 1382 |
| ase/test/calculator/siesta/lrtddft/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/calculator/siesta/lrtddft/test_siesta_lrtddft.py | sha256=pIMxLLuinIg11w5lwLOtoFNLO3xB92XiyKIzSrVfytI | 548 |
| ase/test/calculator/siesta/lrtddft/test_siesta_raman.py | sha256=JYQI8A3RRu6YmrcTO_OpfU-sWD4u8LYTqz8sqmVnnwg | 999 |
| ase/test/calculator/siesta/test_scripts/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/calculator/siesta/test_scripts/CH4/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/calculator/siesta/test_scripts/CH4/script.py | sha256=0EyrwAl7sFFaKeHpXzxZJ8G2l5VPw11dMtPTqrQWu54 | 1338 |
| ase/test/calculator/siesta/test_scripts/H2/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/calculator/siesta/test_scripts/H2/script.py | sha256=-G-KDGK6ZlgYHyxa0gQxIEpuxW6kqk-Qhj93hKzO4fw | 614 |
| ase/test/calculator/siesta/test_scripts/Na8/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/calculator/siesta/test_scripts/Na8/script.py | sha256=5IthEzO8pzLTc80oBDQUCEra3e8N5yYcDxRqfysRn2w | 1409 |
| ase/test/calculator/siesta/test_scripts/Si/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/calculator/siesta/test_scripts/Si/script.py | sha256=SZWyqlUZnbalZ6YoCwZEdH2kYqoYxa7p_kKz8C5i928 | 789 |
| ase/test/calculator/turbomole/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/calculator/turbomole/test_turbomole_2h2o.py | sha256=pinwmNc6MtBI2qZ4F-LH4BrZ5sJMrVN50Y2vk3SFvgk | 3004 |
| ase/test/calculator/turbomole/test_turbomole_H2.py | sha256=u7MtpSFEUi8r3IeRyRYLNCu1fx1KMGaqHYwcspEUljU | 1181 |
| ase/test/calculator/turbomole/test_turbomole_au13.py | sha256=WbcKltg0m1X9lSdUkRGV0vilZaZdR70_oWG0c7eqwiU | 1424 |
| ase/test/calculator/turbomole/test_turbomole_h2o.py | sha256=KUMP_4khR-wOTfioEvLDrzKbhQjOmWLNvY9WRFoPEiU | 1516 |
| ase/test/calculator/turbomole/test_turbomole_h3o2m.py | sha256=Zq0leIJcpoa02l74aLxgIS3dPyAOf5cPA9VIjSJK21Y | 2308 |
| ase/test/calculator/turbomole/test_turbomole_optimizer.py | sha256=zm1D_WLpJbXh14GrjPS9NCItHxRLvjgyzVsTgGJerak | 517 |
| ase/test/calculator/turbomole/test_turbomole_qmmm.py | sha256=imtCVPmwsV4QYn2sC0dESevHPADH1sck6xqvuEZUgEk | 2674 |
| ase/test/calculator/vasp/__init__.py | sha256=O8cNeWI2YQHDGkBlTKc61OUvjoQjazZsFp5U5Eg8kKc | 545 |
| ase/test/calculator/vasp/conftest.py | sha256=sPW706MPrJQgIu4WzX6fPrcfW1uxz_K7wbYNOZkMVGE | 1435 |
| ase/test/calculator/vasp/filecmp_ignore_whitespace.py | sha256=l4r8q0YdLNS_P89xVsZu6dYEz3Fsld0naTqtMJ2Yp38 | 711 |
| ase/test/calculator/vasp/test_vasp_Al_volrelax.py | sha256=siTy2mXIhEWTvz_Yy-Sagq1FAoItR4qktxCcwvHCNRs | 2489 |
| ase/test/calculator/vasp/test_vasp_calculator.py | sha256=NaStIz83OgqTCO7LYb9sBEjrtX5yGt1r-Mxxk4d-Uyw | 4745 |
| ase/test/calculator/vasp/test_vasp_charge.py | sha256=YBk1fzDdTLfNHZ2MxyB-cBzjkaGz-AVcFz6ru98dvy4 | 3565 |
| ase/test/calculator/vasp/test_vasp_check_state.py | sha256=MimzUKNREwdIUBXqQPUdJzzBCKKx9ZyHqN_DEETrLRg | 2200 |
| ase/test/calculator/vasp/test_vasp_co.py | sha256=DbjqXgxrLjsXeV8l_Y8biwezT7quwf16whMbmomR1Fc | 1890 |
| ase/test/calculator/vasp/test_vasp_input.py | sha256=m3Ykdngh60QeS7BNgZtv8u_ohUCVJCR8OOi8ih6ulrM | 7740 |
| ase/test/calculator/vasp/test_vasp_kpoints.py | sha256=tk47jg3lqbTuyJn3pp8iVG0iSRteV7YS78Au9xEIrAs | 3404 |
| ase/test/calculator/vasp/test_vasp_net_charge.py | sha256=pgS9Yf9JpPZ86b0fTAYiDEvBGhHpVSg49xuIT-FO6II | 3491 |
| ase/test/calculator/vasp/test_vasp_setup.py | sha256=m7XjqHCBhw7E_rk_stw1PxmPoe9aS8JbTNh8ojdzY58 | 2630 |
| ase/test/calculator/vasp/test_vasp_wdir.py | sha256=ySTYflP9KdU-AVDh9lKuAgQ3mP0PNurqbisCrBnGaYs | 2386 |
| ase/test/calculator/vasp/test_vasp_xml.py | sha256=ggMeg0pfh27MrbDXPnP_na2RKx7Gul67KAuvz2hzu1M | 1927 |
| ase/test/calculator/vasp/test_version.py | sha256=Y5gl40OpG6xrjdc0JxnwJ2PSBiW0XbjWP_FcoK2-qb4 | 371 |
| ase/test/cell/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/cell/test_cell.py | sha256=YQHRlH6saY7OIszYm6i9xAxIQEVzudt18G8euWcuNKI | 892 |
| ase/test/cell/test_cell_completion.py | sha256=GiLr4EWxqM9Ye1U1lq1CgY4cR_EXfb-TLWkGGjQqdz0 | 667 |
| ase/test/cell/test_cell_conv.py | sha256=htaOimdgimegPD8H0uZZ8La-mX8F3MAP7IqFTIuYbBg | 2564 |
| ase/test/cell/test_cell_uncompletion.py | sha256=9aMKwlDZZueD3DFvy-YiByACKOx9JIlnUKIuGhdwpRo | 614 |
| ase/test/cell/test_conventional_map.py | sha256=vPDsWWFiooh3C_psuBTXEeIq6PkjYpRKzxl4Gcu1Ax4 | 994 |
| ase/test/cell/test_minkowski_reduce.py | sha256=mZGJrzTtLjHiNXtm14cqXMNIUcD3Ivo2R1A2Xo9wnKI | 3062 |
| ase/test/cell/test_niggli.py | sha256=W_LtaWzKMtDbkqZa0o6oCRxIRXnTBMnrAdvkJ9Ski0c | 9910 |
| ase/test/cell/test_niggli_op.py | sha256=SgrcS3-KqTK02hp-oWW8oVDLEsoe6Um07RSUUV5eHqI | 468 |
| ase/test/cell/test_standard_form.py | sha256=13AwLTGDqC3ZFUV3OuMduh2EiCqJhQbJHWKHQzPUfxY | 549 |
| ase/test/cell/test_supercell.py | sha256=mrQebu2pKfxj-OU8gq1hSFWRTw3dpNhZy1TlVb7FzHU | 1930 |
| ase/test/cli/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/cli/test_ag.py | sha256=nYIRsjTgUnBkJ8PtMXAE1tpvlk9RUTWGpZ7RLWxw568 | 246 |
| ase/test/cli/test_bandstructure.py | sha256=yCLgl_OtPrkmvFyRGFHaCo-_NX69cE4tLSEFMY15GVs | 645 |
| ase/test/cli/test_bzplot.py | sha256=S_RMhRX44pyOnaVbyOYCnQXBI_q5sHKHE6w7c9h27ss | 607 |
| ase/test/cli/test_complete.py | sha256=aS4EnVUocH4-W8u0IsPkEFxiMEDSedUql_2e7NFXB7U | 200 |
| ase/test/cli/test_convert.py | sha256=meICwe57JHbeA7N6GjLCapFrcSCCPQxv5yFudGz7u6U | 497 |
| ase/test/cli/test_diff.py | sha256=JdmVpbs65xsHwF7UVd9x_0vjRM7JJhf4H4aFvmPZms0 | 3973 |
| ase/test/cli/test_dimensionality.py | sha256=ejXl2CGvPLRJFoJEsyw0N5xhnll00c2rusTYuJCWzic | 1061 |
| ase/test/cli/test_exec.py | sha256=5SkI740f-mwsjkHOZh-Y5qrXZvslRb6vRu0L8LEVZFw | 1419 |
| ase/test/cli/test_info.py | sha256=60TAZH0QbiTxhwlOXdBEg0zaArNFDU_k4C8hxsTposg | 611 |
| ase/test/constraints/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/constraints/test_CO2linear_Au111.py | sha256=3yTrqTo3dUnpyCbvQGcwA-zqV5x0ZURdfQoS98Zh-AE | 1408 |
| ase/test/constraints/test_external_force.py | sha256=7xEAPn8NJ9j3aCjPhjVm5YQDoO74b884F4rXR-055uQ | 2048 |
| ase/test/constraints/test_fix_bond_length_mic.py | sha256=PrgcczZw8Yxxra4hbdO2ttOJLfrZL8K_oZvCfr8zFyI | 838 |
| ase/test/constraints/test_fix_symmetry.py | sha256=_iagOzjM2mK-LMPWa1giITZJz6AWTo0NDHyS_SS-Wio | 5278 |
| ase/test/constraints/test_fixatoms.py | sha256=SN0yhSQIDJHxgTTfAFkSmJYvxdJASYx1zEPC4_t0Jvc | 640 |
| ase/test/constraints/test_fixbondlength_CO2_Au111.py | sha256=iVCnc0MeFZmCg69Mw-OJfDx3zRLBjmEmUHqI_6MR__0 | 1325 |
| ase/test/constraints/test_fixbonds.py | sha256=_yynVFaYK8qFLD3mw-xhZhRo0_EeFWJSo71m5GYlhp4 | 535 |
| ase/test/constraints/test_fixcom.py | sha256=TkJJr-YA6j8g-ppTH-luxEaU3Pw4FgHVq_tJDqq978M | 443 |
| ase/test/constraints/test_fixinternals.py | sha256=ntShip5-_zBUv5vUMzuJCEsubsLX_Teb8lI65X4FnJQ | 7117 |
| ase/test/constraints/test_getindices.py | sha256=6ja7JnUoLNGjCWBEFfBx7gwkzpD0IC9Aqbv2y_gfkqQ | 895 |
| ase/test/constraints/test_hookean.py | sha256=L8cg3koPw959XIniENeR3nv0d8D7z-wYuqTL9lQsEyw | 2296 |
| ase/test/constraints/test_hookean_pbc.py | sha256=NWLrX0u66RWS97ELq6cMp9BFu5qurA-W65WvOIn7uy8 | 666 |
| ase/test/constraints/test_main.py | sha256=PFFwXRgKK8iyLCKprhwDBWztyCgMgOlBn5n05gULri4 | 568 |
| ase/test/constraints/test_mirror.py | sha256=1qWXiX8dSAlIcdIGcA95U4DNj_alFDxDuhyuBeZ2zsM | 949 |
| ase/test/constraints/test_negativeindex.py | sha256=42i0qNXptOz0Q-e7oGe2Gb_j6L8iG-AmulZJ-zs0eXE | 554 |
| ase/test/constraints/test_parameteric_constr.py | sha256=gvh4bv6yiCpOubfGobVzogvfLkQPZ7mqbPxMUSEtcrA | 4513 |
| ase/test/constraints/test_repeat_FixAtoms.py | sha256=ujTejKeKVORyd6paNplvVoy2xBBnnfq0NW8UfSP6jQA | 1013 |
| ase/test/constraints/test_setpos.py | sha256=hwzeGYzcf-xrXHzy4T8QAljDrpEJF4BDF_vWdO0keiM | 885 |
| ase/test/db/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/db/test_cli.py | sha256=faKStE52bPFW4QcrnunEax6p-s4YIeWvVhPAfDEPYJ4 | 1941 |
| ase/test/db/test_db.py | sha256=zDdwctcgQt76thmTslg9AJk_Vyhz-tLCDZH81Dl2WA0 | 2852 |
| ase/test/db/test_db2.py | sha256=QhgjoIpV4UFIUIwKscdENK7_DMMW_aGFEtITZ6WkPK8 | 4219 |
| ase/test/db/test_db_web.py | sha256=ec1R_NlYmJMkaY0t2bWM9P_OeW-SsL7xPegLK54hPUk | 3188 |
| ase/test/db/test_jsondb.py | sha256=TQ6DAwG1BAfFPwjOftwcPtcJZ_ImAFywirVN89v23rA | 528 |
| ase/test/db/test_metadata.py | sha256=FJ50ray5SsoBTRPM2TD2NdzMHwssouraW7N2Em8uvu8 | 1152 |
| ase/test/db/test_mysql.py | sha256=aMWa74Zr1bJdRwW6GqRc_iYvSwW7jaaBDJ9Vo-oow10 | 2664 |
| ase/test/db/test_o2b2o.py | sha256=ctEwHrTOMLVY7iODkKGvhFnKCDYidmasC_zJXkO6OTE | 637 |
| ase/test/db/test_sql_db_ext_tables.py | sha256=PxiTQuSYwlA_S9BxlnMauxPnIk4qSpdK4HxgySGT8ik | 6598 |
| ase/test/db/test_sqlite.py | sha256=pyA9DyjmrH7ip9AkVT2KES9YOOKHLgaHgeHLU-C7mpM | 1677 |
| ase/test/db/test_table.py | sha256=-7x-LF7JHIJYWPgsIpX-mSWn0yKIGQPAZ6Azv5pCzKM | 729 |
| ase/test/db/test_update.py | sha256=BZpROeoBQL4aCc297pnJVMIMxuUv3IUXiRYYQr4nSWk | 1088 |
| ase/test/dft/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/dft/test_bandgap.py | sha256=5_MjMLiPLxnC-ozuHdDLkPF6pqPpZK0lNpzD_0yvddY | 601 |
| ase/test/dft/test_bee.py | sha256=20IasUjYxZinCvAFGjWeEeWJJD0dnrGwHfDQF0YRc4o | 1312 |
| ase/test/dft/test_dos.py | sha256=PdQ5-H55_Gb4B5N-F4mDaJvDWZeKIZvqXw8xTVaoH0o | 583 |
| ase/test/dft/test_hex.py | sha256=bCeB6lvQD_OZBNGUdFiPct5Uv8eLxSU4yuTKpixBmyw | 1335 |
| ase/test/dft/test_interpolate.py | sha256=XOdbJjCpCIgnojhwpy5Vom7XVytcOXikrXyUacrmVCo | 375 |
| ase/test/dft/test_kpt_density_monkhorst_pack.py | sha256=tvsaalQWUtCL-DxyihHUddQUVQBfsfXGjcQmcGjkzfI | 289 |
| ase/test/dft/test_kpts_size_offsets.py | sha256=p6RJdzNXbwzsTgWBOgJCJdx4ExdaQTjiFl5ZNYgEvLU | 3255 |
| ase/test/dft/test_monoclinic.py | sha256=mhrhwFnLs9U-DYc_56ocDXR1WUMlc4OZ-16yyrto2L4 | 1252 |
| ase/test/emt/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/emt/test_emt.py | sha256=Y-YLpGr9rqSmMp65XTvhwse6DRb3Q6t52TNxnYPhdk8 | 1829 |
| ase/test/emt/test_emt1.py | sha256=r_nbKhVL25F1gyOGorOexvUb74gXmLxb4HvrcC3Dzr0 | 752 |
| ase/test/emt/test_emt2.py | sha256=pDQYsgYNp2iVjCFwyQTUOLFOsR2qZ7JLy8lCNCPdqyw | 445 |
| ase/test/emt/test_emt_h3o2m.py | sha256=Maxgcu6iUbxz9zxZe1x65I3qJjmcTO4MWQYVTsaYDNA | 2015 |
| ase/test/emt/test_emt_stress.py | sha256=KbbS7Qrptpf8EPO1rqfjqcmkMXVwZHijDL2pqVG5qLI | 788 |
| ase/test/fio/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/fio/conftest.py | sha256=ZlTjXRnTe0KG5LZc-2Bdb1lvz5ivzpnteu21ToOma78 | 87 |
| ase/test/fio/test_abinit.py | sha256=6COc33iQbRXCzpagD7fd8ux6UuJAMNvVMFek0l5hxuU | 3899 |
| ase/test/fio/test_ace.py | sha256=447QntmQLZwcxfHVI9ydhi_30M5TUX8vyg5CvhgLRHk | 2297 |
| ase/test/fio/test_aims_io.py | sha256=68SW5Yl5rjXCNCzlMzCYpo-WKbuiMqgY-iImwIEUWTU | 4078 |
| ase/test/fio/test_animate.py | sha256=n43rQydaWFL4s33GW4303HTHcHbznjSA9rvYvRkoDQI | 845 |
| ase/test/fio/test_atoms_bytes.py | sha256=vsvx50zGfk9PiKQuJTq8AUftCjzUEuCAhxxpcshfcrg | 662 |
| ase/test/fio/test_cfg.py | sha256=KcU5R4rvrM8I7XL49tBHmGszIQ3wpwSg1gTKBuucbrs | 455 |
| ase/test/fio/test_cif.py | sha256=kuouHneReESsXARAK0eKzMscu-aghS33FTo2-gAuv_U | 14677 |
| ase/test/fio/test_cifblock.py | sha256=tHN4o9UZOMUjylHP4YAVAgxIBvnJNDdntdpNV6MpG0E | 1843 |
| ase/test/fio/test_cml.py | sha256=Lpv70kAeY_eZYgNXxY11BZvqxSiuDBB8CEChBGlEI9o | 2295 |
| ase/test/fio/test_compression.py | sha256=WXzShZJs6SgelCDWYFNUIxLGzPfGKJ2265HFRK9tPKE | 2892 |
| ase/test/fio/test_dftb.py | sha256=iurA7nF2E2WvTePdOoRYY89731K6Gxts7IXy56MvSXA | 6897 |
| ase/test/fio/test_dlp.py | sha256=3IqhEeVZDa17BfWiKMAYn9hKwG0YjMQRo5ztooCj1kk | 8777 |
| ase/test/fio/test_dmol.py | sha256=VOJdwDH4QcANU0XkcpBU8dgIqb7Sgc9iL4Qd2jOzYmc | 2242 |
| ase/test/fio/test_elk.py | sha256=E78cru7doMEfzJ8vSX3dj-vmSv7DtAKOPiBERwpQw7c | 1939 |
| ase/test/fio/test_eon_masses.py | sha256=Mfu6U9856pFHEAK5DGgA_vAW-gJ3CqjSJBjh9M4xeTg | 871 |
| ase/test/fio/test_eon_multi_image_read.py | sha256=wgBNIIO_2gXTlZspoA5XlyTwe6A2P2YcXpPYq26RBmQ | 16276 |
| ase/test/fio/test_eon_readwrite.py | sha256=NF4Z_GB72aFbgsiOQkGVh-Gj1kTCxNfrR__oW0EQQ5w | 13128 |
| ase/test/fio/test_espresso.py | sha256=8wk0ZWEOTlmtIJlFpF7Bpgu0IJojaisi1GiCbBpslcg | 13464 |
| ase/test/fio/test_exciting.py | sha256=qADwvZuN3M9WwykMCqBe2_QM_VgYC5_ZzVbhO44Crng | 520 |
| ase/test/fio/test_extxyz.py | sha256=3jUCDsjf2-G0Fm6tFtvkToGHhitlL6GKa6u2RWYWON4 | 12578 |
| ase/test/fio/test_fileobj.py | sha256=-C4MISPsC1lq1nv4W7jbruTlBahubh6BrRxuncgbj9I | 1302 |
| ase/test/fio/test_formats.py | sha256=bnzG_OsV5SU6gMhZ_v4-roOyKVoXyW-12n4n3xyrG_Y | 668 |
| ase/test/fio/test_gaussian.py | sha256=q5yuKwS2sowouNQImzMF4Gqc5_jJSvHeUpo1e2DmcIs | 20160 |
| ase/test/fio/test_gaussian_out.py | sha256=wWhDZF3aAKDRtp2ZE-atKgAQNfPKcK9fBt3rfD2AeuE | 2314 |
| ase/test/fio/test_gen.py | sha256=e04gq_LjTb6ItN1M_GxKSt8NYVLBHDcs0ErnNKJtzUY | 1197 |
| ase/test/fio/test_gpaw.py | sha256=NglJB9XdrHms7k7OmhxzOPV_yQAvXuW3N_mkbmb1cCY | 1336 |
| ase/test/fio/test_gpumd.py | sha256=5n0U5KjrWwtiwczftd2pLKPHgM0Ea0W0VhGADHhFaI0 | 5631 |
| ase/test/fio/test_info.py | sha256=kJfZwIYxVL6EzU-VuEmX6LUJib-houKYRDmxW4goAtQ | 692 |
| ase/test/fio/test_ioformats.py | sha256=m0NY5qmS5H2tiuZAzcL0i8aumZIVZfl_RaynZGJbjqo | 468 |
| ase/test/fio/test_iread_path.py | sha256=pPH0ljRCAqVozxfLc-H0Jqd9Lokjodqo9fyq1w-HoXw | 207 |
| ase/test/fio/test_json_arrays.py | sha256=L8soK1Vfk_fRnPhPu6hez6Dox2HoD7ZtJQeySvJH1AY | 725 |
| ase/test/fio/test_jsonio.py | sha256=yhBfeOKkqqhQ3yLDPeLcRClWL88E8xeVthh2JZR5YVc | 752 |
| ase/test/fio/test_jsonio_atoms.py | sha256=zLpQ8sTvHfVvTJereUW6k8p6Nf-2KZI9J3kgIc1QRVY | 1152 |
| ase/test/fio/test_lammpsdump.py | sha256=56g5M1IWT_Uwc6qoU6gt0wv556NUZ325g9RFQ2M2cOM | 3756 |
| ase/test/fio/test_magmom.py | sha256=HuhcKrpT2E9M1DOjQ9su1MwaANQTllHGAjyxyhd7M0c | 382 |
| ase/test/fio/test_magres.py | sha256=KH53Zz1kC86n5rmBWeWv5uN9X9IBYZJuXfopKG_3Dxk | 899 |
| ase/test/fio/test_match_magic.py | sha256=6EXH5dmirHAaj-WtOM4tz_LOoKTgzyVqnlZCV53klYU | 299 |
| ase/test/fio/test_mustem.py | sha256=kkMPY05s0L9m_zB0pkT80Me8lPWVcfYG06x9ieYhsJE | 5488 |
| ase/test/fio/test_netcdftrajectory.py | sha256=FOtBcSDoVifw00qm7Z3UvPS6YjOtVUJ7gQT_CLh-Adw | 6769 |
| ase/test/fio/test_nomad.py | sha256=7Y2qr5z_OOAPWa-K1ZZqzdxjz0dB9me0VZpQ3L2ODpg | 927 |
| ase/test/fio/test_nwchem.py | sha256=770Fu25AmQAzWoDzRirDHeg5UMs0rIRX-x2E-5i0UyE | 371 |
| ase/test/fio/test_oi.py | sha256=ht7AETsuRukiNkqRjzchMcnJtzUiSsqwvnc9dyCBcPo | 4108 |
| ase/test/fio/test_oldtraj.py | sha256=HqVxXN2XnF2kBgTGATrBVuP7sldVgTKDKBKi4Z51IHk | 2389 |
| ase/test/fio/test_openmx.py | sha256=DkmhKGL6Xo1n5e_GrxQKFN0h0aF9cqTya9G8rFYBF9g | 9622 |
| ase/test/fio/test_opls.py | sha256=UzGXstedvDYdQFezpP-4IgmgJbldlRgy3prsKf_8zIg | 2537 |
| ase/test/fio/test_parallel.py | sha256=J_alLjggeLxcSKFEyMOFYHndMCSvfVZHYV7Oac5XsYw | 288 |
| ase/test/fio/test_pdb_cell_io.py | sha256=t2WFt4824DIY5Fr3skztTLqy7EPBlJD_tIqXfTUyyRM | 6234 |
| ase/test/fio/test_pdb_extra.py | sha256=fsTnu0JD0aPLHkEZZ-zeMsi8rZ4gCBd2Q04dsc5PXp0 | 2374 |
| ase/test/fio/test_pickle_bundle_trajectory.py | sha256=GYlxnKc86lvtDFfdyiCpaupe6Iq_k4EojTal6bbtb-Q | 4101 |
| ase/test/fio/test_povray.py | sha256=gXiG8Jl1u9EoaPrvfoudZcAckt4woTh0kDF7HMgBE3w | 1250 |
| ase/test/fio/test_prismatic.py | sha256=ybEfAaJK2_YGSoLhUOnLsTi43MrKqiiK7hN_lDtMYoA | 2712 |
| ase/test/fio/test_pycodcif_read.py | sha256=ckir4GtqiylHOHFprlP36l9qS8ckG7pCcPKP4l1MZoo | 1190 |
| ase/test/fio/test_qbox.py | sha256=djFWFEoJs89HHdfMM8GetcBn2wlU5yn7xKAIB39arpM | 2078 |
| ase/test/fio/test_readwrite_errors.py | sha256=Q5LU04bEZM6XG2E6PXwXuKM1xnra_NPAtYPprn5Q9Eg | 3035 |
| ase/test/fio/test_res.py | sha256=VOMbQK0tn3o1OR_XHu8mt-pVCLk-qrP5sfrecEizOr0 | 12773 |
| ase/test/fio/test_rmc6f.py | sha256=bFSZ10SGQR32IqTIniHediRJz6QnXFPeQFsoxZv4P6s | 9363 |
| ase/test/fio/test_siesta.py | sha256=sbZ6chjxvAh9co4QA-DjrDV7UWa_76k0pxu5AKEVM1U | 1823 |
| ase/test/fio/test_traj_bytesio.py | sha256=1tvmkwgb_jnVmedNodKmgbomRbrnF7_gMQBJiVIqOyA | 466 |
| ase/test/fio/test_trajectory.py | sha256=cU1YEku0QkHn-4q0UPbvqgPlXHecLgt9VLVzJXk0tao | 3082 |
| ase/test/fio/test_trajectory_heterogeneous.py | sha256=6kgPc78LeCF9QEWgnOCj3NNfI78e7WFA7RLWz72crhk | 1519 |
| ase/test/fio/test_turbomole.py | sha256=4CtDcITbYFyXGWi7cEkI0vbsKvm8awhab9F21v0x4mM | 485 |
| ase/test/fio/test_ulm.py | sha256=RqVQEDraU58FjL5G3wdL3Je4okxPvqOw_-rxVg54-7s | 1981 |
| ase/test/fio/test_ulm_dummy.py | sha256=pw7HZQBsp_TjjdEOayXnNdldqj0PzZ-WWchA7PgnKpc | 438 |
| ase/test/fio/test_v_sim.py | sha256=9-20IwX21H0gftIYbskl-imj-eoGR5lPMHhZBj6R0MY | 13551 |
| ase/test/fio/test_vasp_structure.py | sha256=xsF5FB3q9RRgXCBBs2cD-c4xYRNsd2NSV6tGzLj_XTo | 2821 |
| ase/test/fio/test_wout.py | sha256=ebeVUPX4XzxB4AWuAXckHpfGrtrEqwFuT67zRqsiQFM | 1410 |
| ase/test/fio/test_xsd_bond.py | sha256=9oBOYLaTt5rvwxuAk6s77WacXM_ayIwS3B4N9FDuNxw | 2825 |
| ase/test/fio/test_xsf_spec.py | sha256=WmEf5NXM1FRv9xQLj3FKrdYhn1Er0EVXJFXMQTnQEao | 8731 |
| ase/test/fio/test_xyz.py | sha256=dlmxX0EvDPYoP_yDYPcaFhxk3lyz4whUy9bMF4ywLl0 | 2730 |
| ase/test/forcefields/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/forcefields/test_acn.py | sha256=Bos47lknDp1zvsmsxKI4qpv0XkNlKQvI3egrIzEqaPU | 712 |
| ase/test/forcefields/test_aic.py | sha256=oGV6pOG76tDRCTvuZ4lqo-dXpRcJS1TaSt9M6Ud3j8Y | 443 |
| ase/test/forcefields/test_combine_mm.py | sha256=WB1aeXBPSffEJq1XiSKlxwhrgNqwcHRU_JbX7_ueZzY | 5292 |
| ase/test/forcefields/test_combine_mm2.py | sha256=vH8vK7aVH5QADQ_qTeIa3C70ylyD0Vo0YPn7lhBLcnc | 2445 |
| ase/test/forcefields/test_counterions.py | sha256=5RhKTYfKHfhXBt7dI-KTavlpAtsDzjejYlRJ4pD5yig | 747 |
| ase/test/forcefields/test_forceqmmm.py | sha256=EKR6RVL2mzRV9iPHXobsl7O2WFVAEfPU8TBBxKGSEeQ | 16100 |
| ase/test/forcefields/test_qmmm.py | sha256=wHEkOZKRzT8mH0R83spDvOYUv6RHEn556d7kcDRE2g8 | 3221 |
| ase/test/forcefields/test_qmmm_acn.py | sha256=FW2ONqM2TQFrrxqjpm9uBaVFD6CwIrC0ZkrWfSn6WUg | 2158 |
| ase/test/forcefields/test_rattle.py | sha256=gig7jHA58gQeWSED9RvbCVbGidKjJVNtu2QhUv1H7bY | 1430 |
| ase/test/forcefields/test_rattle_linear.py | sha256=CSYh7aky7mRpRXzIbnGgL2laQWg0WcDCV-4IkNemohE | 1914 |
| ase/test/forcefields/test_tip4p.py | sha256=gEGXFglkxat9fThPW9dXWGsE43IQZURQ0259Uqx-yjY | 826 |
| ase/test/forcefields/test_tipnp.py | sha256=I38dtjyHUjZHL1AYzz4CoPY1EAM6YKnvoH7R1FZLhX0 | 896 |
| ase/test/ga/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/ga/test_add_candidates.py | sha256=M980srNSw9EY2j1cSq_T8RFvrGtFYbS-tSlNwWZ1xkA | 1843 |
| ase/test/ga/test_basic_example_main_run.py | sha256=4o8nUufCS_5-C3L2g8KAdJ9FYp8SguK05gn0UcqR-fc | 5725 |
| ase/test/ga/test_bulk_operators.py | sha256=lqynGR2mmsKSz0zYePO07ud1QKlWzNFjtx1i10mSgK0 | 4675 |
| ase/test/ga/test_chain_operators.py | sha256=vdJmheb0Y4KvBxpRM-leF06eDci4kFEczWzhXedLDCs | 3089 |
| ase/test/ga/test_create_database.py | sha256=B7uF0_hc9sOKcp9rSAN_mfjrEzPyGIHJH7J5qwRtrrA | 766 |
| ase/test/ga/test_cutandsplicepairing.py | sha256=71IZz_lMZ19sL-qlWLa8DA-Cwb6IqHu8J1sjy-BU2Dg | 2323 |
| ase/test/ga/test_database_logic.py | sha256=_08yNc3jezRfly58Cj88Uu6fXeLmRzPOucFoSS2-ZrQ | 2668 |
| ase/test/ga/test_element_operators.py | sha256=npMpm2IJX4JLC3gJWkTe8g4q1ffQFXOz7pVcv8HCpIs | 2587 |
| ase/test/ga/test_film_operators.py | sha256=_7PvMKjM6dCTR0s6L0KihvGFV4QKdfTUqyeJKYaURMQ | 3269 |
| ase/test/ga/test_mutations.py | sha256=WZkE3iGaDDMotUGGS8mjacMvGUDfzKI2X1y1Q2wc2vY | 2610 |
| ase/test/ga/test_particle_comparators.py | sha256=QGqPt1SORKXj9wCmM_RT2wwdEqqKEMP7NaZIrAeVJVg | 1118 |
| ase/test/ga/test_particle_operators.py | sha256=HOKllU_cm84Feduq_AOIgFrBszggaoZ5RdFMaSpeGkQ | 2074 |
| ase/test/ga/test_slab_operators.py | sha256=M-LvuKxn-7xMpFEDj1FGNXqHNzYu5C-rLPZxrb5rlx4 | 3032 |
| ase/test/ga/test_standardcomparator.py | sha256=b3lgWg0nRAHF5PiMhS-__SYXEDHSoT5v1ebFf1AYnJQ | 1990 |
| ase/test/ga/test_utilities.py | sha256=dEtT1xXAZyzpRar-Pao49o8xFMNqfuhfU42EzCFBeBs | 1498 |
| ase/test/gui/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/gui/test_run.py | sha256=gUlz2pzIJvLHlJcyV51Nsog5yNVGxz1fOWiMWKmQdms | 10859 |
| ase/test/lammpsdata/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/lammpsdata/comparison.py | sha256=uehjznWwWdihvVo95WP4TuqvydWAiap5W3braiUcPYA | 388 |
| ase/test/lammpsdata/conftest.py | sha256=VVu5untsZvtmqe_lZ13k22AIBZPFgJZZ_iRvFFmIbQU | 634 |
| ase/test/lammpsdata/parse_lammps_data_file.py | sha256=1ZJHQ2WmXnoui8LoeA6hmoAHV__DotEnZiMAmykcEPE | 4834 |
| ase/test/lammpsdata/test_lammpsdata_read.py | sha256=083FIWYOjDakBVc9OLqAf9MZ_8Bn9_V59iBdH73xk2U | 1689 |
| ase/test/lammpsdata/test_lammpsdata_write.py | sha256=Ubb33wfM6UvV4doVLFfMrQx4yb2OO2meK7cvtzq8lXQ | 1371 |
| ase/test/md/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/md/test_CO2linear_Au111_langevin.py | sha256=kSiB7izWm7aBBiKN15BbV8XZPbfyEMtI2Rjrgfe2Kg8 | 2018 |
| ase/test/md/test_ce_curvature.py | sha256=ddNLIuk3WRZXsmW__hpn6Xm7EHggv98ryxEIM8Z-v7Y | 2384 |
| ase/test/md/test_ce_logging.py | sha256=GSUu2ATCNMrVFMyPU_z9-yVc6xn4VlBG4x_fiYyyguk | 2938 |
| ase/test/md/test_ce_potentiostat.py | sha256=I5oWAY2fwvM92HwdYCEJHCGprYGdIFJ6fHHS0potUu8 | 2831 |
| ase/test/md/test_fixrotation.py | sha256=VVRpBbrLkk513ifLSUso2EghHBd5PCKUF1bqcq4fT58 | 1609 |
| ase/test/md/test_idealgas.py | sha256=tPIqxnCtW4RRcTMzHV_ebKfMBPXvEbvmri8dJRz7eKk | 1142 |
| ase/test/md/test_langevin_switching.py | sha256=67I2CNE68R-TtwqJTzR87eZ286IUCy1NXM0TT4FpTqA | 2066 |
| ase/test/md/test_maxwellboltzmann.py | sha256=_hQhikCBF0shdl8mcj_y32MivHUxeFK1H9TpPCEKDfM | 506 |
| ase/test/md/test_md.py | sha256=3Qo-6TrL9CJxLzUgIyrBGTcD6MtM0XHxv_k-xyK3YSs | 774 |
| ase/test/md/test_md_logger.py | sha256=erf5geZyx_MXtHokNrFYlkrA1Im_KWZa4BwM-PgkfDk | 2664 |
| ase/test/md/test_md_logger_interval.py | sha256=lP4Z3PRsUMdDSOM_8VfsvaZlr68zqjjbUsndqiUxzgg | 2605 |
| ase/test/md/test_nvt_npt.py | sha256=O3GK4Au0uka5Lkzv5o3pFHHfRwxCoXSYi9Y009l3LD4 | 4039 |
| ase/test/md/test_phonon_md_init.py | sha256=ukRr62pHXy9YTWjpp2sgEwkMpOyb7NU7qd_ajfKqbEQ | 3156 |
| ase/test/md/test_velocity_distribution.py | sha256=uh3xSatvy6gIXBgFyJcwn1JvuuihExOGcOG-veW4Ld8 | 1515 |
| ase/test/md/test_verlet_thermostats_asap.py | sha256=bOVMi33iK1watXgLhKCSuH_yoJZqDNta-aER6qiEJfE | 3554 |
| ase/test/neb/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/neb/test_COCu111.py | sha256=1j_ujmB4SkOjCvOcSU1KjdKF52Yi7SES45X4Fg0uHZw | 2312 |
| ase/test/neb/test_COCu111_2.py | sha256=uI_AklvUPv30-BZ02AW-PseGAVR1XlmI7auL9fsP9Gc | 2813 |
| ase/test/neb/test_autoneb.py | sha256=stP_D6ZfUFxd6w9DG33l08dk8n6Kxoz5jANuTc5Z5_o | 1458 |
| ase/test/neb/test_dynamic_neb.py | sha256=Eygn-FafKGlU5TRBXrXqmNbnb0A07gk48cmbHW_pmEA | 2857 |
| ase/test/neb/test_idpp.py | sha256=hsQU3Qfhm2x778UDS9Im9r7phFVVgmbo-KQfsZJnXF8 | 575 |
| ase/test/neb/test_interpolate_images.py | sha256=QjhO1fNXf1y4ZAVwPz27GFBuQhqmTj7vSKq-l2qm0jc | 2680 |
| ase/test/neb/test_neb_tr.py | sha256=-q6iXnCEvE1ULHU8Z0ZHqqPlo11Y76FP3ldGI97QCJU | 2507 |
| ase/test/neb/test_precon_neb.py | sha256=5JNX_IBwD9mEQhpZkjhUeSneoi-YLiHFvMW5bxAT_yc | 8239 |
| ase/test/neb/test_shared_calculator_neb.py | sha256=BZZ8zmDw-kzTpiFK-JGRABbzUxwaFugeiQbYn27HbZI | 4943 |
| ase/test/neighbor/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/neighbor/test_neighbor.py | sha256=kHq26rM7iDhFxfM6YAS6ypRTtVkwV94cHP-1qhNrKOQ | 7283 |
| ase/test/neighbor/test_neighbor_initialization.py | sha256=MZ0Kd9FEJILON1Dc_DMhqxiwIPVDob77itlLyYUnq-M | 487 |
| ase/test/neighbor/test_neighbor_kernel.py | sha256=pL7iMAoNG7rI2XkSEN_9E6USSvpQmu9h_DTv338IQOQ | 7826 |
| ase/test/optimize/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/optimize/test_bad_restart.py | sha256=dPSFRZjPO0eBvWMUVoa_4huX8fJd96lpSi3fdSS3tnI | 306 |
| ase/test/optimize/test_fire.py | sha256=7m2Z9TLZhYSprFxiSRKdgojb7XsId5VlILctryQEzZE | 872 |
| ase/test/optimize/test_minimahop.py | sha256=NXEZlYn9hTVj4qZdVXDIJL3i9-k0ZTCp65ViOQqrkv8 | 1624 |
| ase/test/optimize/test_optimizers.py | sha256=VWNaCoO2Og1BN9kw-k1yg3MCIUStJVEVLT0QEVTySIQ | 2384 |
| ase/test/optimize/test_replay.py | sha256=YBljqI0yRJVB-4sTbDmHGjmX398N_YvvUOEF5nPx4Lo | 1057 |
| ase/test/precon/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/precon/test_amin.py | sha256=NWAUFF0VxjTk8ekhw3FH09A6LYnSU_F3ixM-Bn8DQEI | 1026 |
| ase/test/precon/test_ff_and_precon_c60.py | sha256=Wg2Z_QiZEQkHNWQgzYnF8FQ8fs21UM0v8gXzdFKOEA8 | 3152 |
| ase/test/precon/test_lbfgs.py | sha256=cCMml1Jjm3nHvKKZzVSSE298KAvofwIOTs-fOTxRQvk | 1618 |
| ase/test/precon/test_precon_assembly.py | sha256=pOOrBTJ0FDc85O1jKQcAyOiZaBsdcN_cRf7aTQnGS6E | 3266 |
| ase/test/precon/test_smallcell.py | sha256=jxd0HzAs0XwTCDpgFQqlX8y4hjOYYtXnDuXumlQa1Oo | 279 |
| ase/test/precon/test_unitcellfilter.py | sha256=AP2iBFSnp_WEhf68PDuD9IP8UG-5kNWOKYT8xKr9Ts0 | 999 |
| ase/test/spectrum/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/spectrum/test_doscollection.py | sha256=RzaIt4nD5OCjuUSxpiV4KH27J78UbqjAggOj4Ziwcdk | 17222 |
| ase/test/spectrum/test_dosdata.py | sha256=bBBmn2MwomjC_0qilrqSZ2FFnwR9vszWMy6TIQSkxR8 | 14876 |
| ase/test/standardization/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/standardization/test_properties.py | sha256=zIEpPJvNjp-I80Lhrk8t__QWnBz4zxcr8g3JYfubiTw | 499 |
| ase/test/testdata/172_defs.par | sha256=Kuq1RjNq6P7P1jzLx4Vd6qUb0w4v1_cIAJvUo-bPceQ | 680 |
| ase/test/testdata/eam_Pt_u3.dat | sha256=bxCGz8raB2_-_dRCpydO0MNENbygnSvln28UeNrdRG8 | 36575 |
| ase/test/testdata/gpaw_expected_text_output | sha256=8Vt3QwmYsG3M_ldO363zTBMqxawRPOtHFBZxI4Q6zo8 | 11658 |
| ase/test/testdata/lammpsdata_input.data | sha256=XJyyUQtgkpJejCmk1Vf4UxCwu7TJmZLaUOEgj3e2PHM | 1726 |
| ase/test/testdata/lammpslib_simple_input.data | sha256=mF0oaBNsJwxTMfNUgoQ2PQ8_sqi1D8w7WYNh39fYpQc | 1788 |
| ase/test/testdata/nomad-images.nomad-json | sha256=4shAQFJPlu5oL_IiS8Ciu1IfetQfnbK6E_6Xsx4O2Jw | 11818 |
| ase/test/testdata/opls_structure_ext.xyz | sha256=mU2mLpfGGqsuH8dGYDMqqJAdoiBwrSDm3avR0Txqvr4 | 381 |
| ase/test/testdata/qbox_04_md_ntc.reference.xml | sha256=Hvq-u7-cpzCouWJeZxLozcsRpulXqwqvG1waqNeS9RE | 36621 |
| ase/test/testdata/qbox_test.xml | sha256=-UFqGg_yeIJ_CTnixdrN_aJiDbWhtuKOsUjZaoJVuSA | 21586 |
| ase/test/transport/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/transport/test_transport_calculator.py | sha256=qQLRciGV1HRjdNJEuzAcOTZYqoeSEcD5YZCYfLNnQM0 | 2464 |
| ase/test/vibrations/__init__.py | sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU | 0 |
| ase/test/vibrations/test_albrecht.py | sha256=c4xDcmqyYfY-poGuu6HsbOsxAdD-Y2p6qESYlPRiOyU | 2701 |
| ase/test/vibrations/test_bond_polarizability_raman.py | sha256=pyfjc3vgBoIrGfI-3xi_TemAFbWMd_nRNeSrNJESMqQ | 2715 |
| ase/test/vibrations/test_combine.py | sha256=bNyZX7m3lWCPnFZHaAg4Lapakm5yf-WiqFoMMOTy5wc | 1239 |
| ase/test/vibrations/test_folding.py | sha256=I3B6Txzd5_cFTwoKooJpPtyNndxxfPd_lboDU35lef4 | 706 |
| ase/test/vibrations/test_franck_condon.py | sha256=_Ot4FULNxFp96b10FizR93W0e8JSdIUQlmBhAH_1qT4 | 4411 |
| ase/test/vibrations/test_pickle2json.py | sha256=CHKZYUDLb6HM4bvey7spz6YxoHVNftu7evZnL3uwTh8 | 1239 |
| ase/test/vibrations/test_placzek.py | sha256=9W1B5zt3QysBrXX5YG8I4Gvy42wcKItsMmffDGdmlV4 | 4056 |
| ase/test/vibrations/test_profeta_albrecht.py | sha256=GNwypcVUTSbBKDxXikbzoCQti7K7Kjquo2DI8zfXgt4 | 1991 |
| ase/test/vibrations/test_vib.py | sha256=w5UiQENI6-vZi680lsiZM8s8wtISpo3YaKv2gmIlCyE | 21679 |
| ase/test/vibrations/test_vibrations_example.py | sha256=8Dl8uyeoN4C_wd32i1OGXvwzZ7Ruv5vLdVH7eyc5nng | 838 |
| ase/transport/__init__.py | sha256=rkEtNJ14tD20YhuFNSOJjGFmFpafnLorUj5CKpOrP84 | 79 |
| ase/transport/calculators.py | sha256=ynuvxcBlTgktKWCAnHf1AQlnnfabgEGkSuu0n6dFBaM | 17210 |
| ase/transport/greenfunction.py | sha256=2JLkdnjjqBaDR76V8D5hVUxjSzSsxOkTSLnXB_49rSo | 2121 |
| ase/transport/selfenergy.py | sha256=6-drmyFVonM67APSV_nW4Vrp79VLEH8F0nS1gej0IgY | 2857 |
| ase/transport/stm.py | sha256=iHwgbqKIJYpR1bCbAmcWeX4MyfJ5_o7AXa-seKa5VnA | 7535 |
| ase/transport/tools.py | sha256=6bwqjALzgLzKipoFnolAbq7SPwMhzAKPSA6w1oYGuaU | 1978 |
| ase/utils/__init__.py | sha256=lAOCBJkcnXlaA4kcL07NhEW-cj4X4TEyWhuU3_eYRi8 | 17130 |
| ase/utils/arraywrapper.py | sha256=7JMSAmpT7E_p5XWJEK4CExJa5z4SGwprLhqDzYHG2Sw | 3270 |
| ase/utils/bee.py | sha256=DvYHqyyLfIgjvdkrKZ-4xMPiZawDAk960jHd3KYAfoU | 1314 |
| ase/utils/build_web_page.py | sha256=lxuFgZaQ5pvet3bZbp-LdOYn-Hg8WnX4UyCm3c8Lsao | 1404 |
| ase/utils/cext.py | sha256=8TFqoRn8nl2y7wnugZHmr9JAVRT6-JQXCgbqMK04foQ | 519 |
| ase/utils/deltacodesdft.py | sha256=zZWhlXSTJDAl6ssGqT-cTOLeEHZAm7fSWbnsCqM2FEQ | 1033 |
| ase/utils/distance.py | sha256=tCy7fveiICSPqg6jQtECc_QX_tBDMLr_OODwegDU05M | 113 |
| ase/utils/eos.py | sha256=rI0l_USzWdFk5NMY9H7v-KHEjvumPNFQg1Eqi_rZjpg | 117 |
| ase/utils/extrapolate.py | sha256=_n2zWHQPOfFaLr6OW8il_A9p4HQTvDr_eKGpYrNlguM | 224 |
| ase/utils/ff.py | sha256=Wurw3mxrD1zALZikQSH7CNh61JvZBB31JcZqd8Ost3c | 25728 |
| ase/utils/filecache.py | sha256=i5YGppH_GXKlJs0p11JwaHIoO8iuMLuIaaQ4B1DPnn4 | 4641 |
| ase/utils/forcecurve.py | sha256=DK8Lo6Hh3J_Lzfyloa2Akgfnvgeih_Qx_TBZgcssdWU | 6047 |
| ase/utils/geometry.py | sha256=qVzENSBK2fyERVVuy5mdl17EFpMYUXqGOWmbQc696PM | 415 |
| ase/utils/linesearch.py | sha256=CEey7OZgjRPp7B9go_EZw57cxroQDjJy8WKELk5dWFc | 14405 |
| ase/utils/linesearcharmijo.py | sha256=fpSE_FGFtQd9pNKgtDVIqchPW3pARcGMPOT9EkFh2J4 | 17436 |
| ase/utils/newrelease.py | sha256=lqSAj6_GxqkmBS3rG8N9NI11B4QQaZVHYqhlYwuLpv4 | 7428 |
| ase/utils/parsemath.py | sha256=R_u1tWK3HXhnKWczC2Wx87kwf17SbwePPZIwgp1OFeo | 5345 |
| ase/utils/plotting.py | sha256=-KZ2F1hLQxK5XLpKQX8fG3mIgOW6SAjjLUELhwJ96Z8 | 1250 |
| ase/utils/sphinx.py | sha256=DwW3yQEzCBYc0wb7ElOFoXlC1e9d8W28lHGLM82OGiA | 6263 |
| ase/utils/structure_comparator.py | sha256=I5AMQAN6QAIxJEmCKiqdPvEZdBxDz3pjoOEEiIY30fM | 23355 |
| ase/utils/timing.py | sha256=rM9VMOfsq60kKJMwa4_xeIexvWoY4_Dg5ZoDm4Ihwjw | 5147 |
| ase/utils/xrdebye.py | sha256=uwVpzc0WwGrSqz0JRuDAqYtsX0Exf58C29VTYJ8GyZo | 10098 |
| ase/vibrations/__init__.py | sha256=10SsCwYtq57MZ40i5UCWOcamEeMnLHzbmC2riixj1OA | 196 |
| ase/vibrations/albrecht.py | sha256=j-YkVElLgfOxP_oPoeuo3z2TmrSl_VP9KARu1anmv8I | 17308 |
| ase/vibrations/data.py | sha256=G4OUhUCR49MlfFWqnTU3hVk4bgKTcNjccVuEXZ2aciM | 21963 |
| ase/vibrations/franck_condon.py | sha256=4GUkdkZslgktFIdZamwvo7bH5Yd9ib4SndJ1qctMm0c | 13182 |
| ase/vibrations/infrared.py | sha256=c2vdUvChrOx0bkXQWxjBncUrgxqG2fN6wHeN4OuXvAo | 12823 |
| ase/vibrations/pickle2json.py | sha256=Zy6-zUE9cewzIMHH37NviqHtQCw17zhw1XLFZtbtBnA | 1491 |
| ase/vibrations/placzek.py | sha256=8YK3OhlgtVpRIx1fviX8Dvt6laf7fZOq3SQuHnA_ETE | 5751 |
| ase/vibrations/raman.py | sha256=Dndu30PwgCfTAWMtAJbGTljDs8hE6cWxCbZ0Da-qBbg | 12879 |
| ase/vibrations/resonant_raman.py | sha256=SViJxWTvd91zHmEKQ7JR-M2dTAXru3VrfES3rZOHM-A | 21365 |
| ase/vibrations/vibrations.py | sha256=TpTVg-f9JCWZivYzTa8VL-qL-Xx4qn_pQw36fgTKX5g | 19648 |
| ase/visualize/__init__.py | sha256=UtH95TXdyjlDjWItKOqgze1bXnEG190AxMGBiPH4XOc | 516 |
| ase/visualize/external.py | sha256=QzXlcT4qHb7OSPfruAQYa-QfrLPuJMwsbFRM1x1OPNk | 4145 |
| ase/visualize/mlab.py | sha256=I6ovTls-wDFXIlQ66qOKPOvQ11BSZHpMHvgaZwHZKlk | 4367 |
| ase/visualize/ngl.py | sha256=jNY4fB9isdIyrFRpyRoDmrRnrbkvA95xQFdvgfXc34g | 4271 |
| ase/visualize/paraview_script.py | sha256=ZSBqDrQD-i6lt-ey9UGKSkqGMDUi1XNR-XbM5v_1XfA | 929 |
| ase/visualize/plot.py | sha256=kdD_f2Bs4aTP3e2szq364uIPGZpUQqWX5SAhx0Uzj_E | 3130 |
| ase/visualize/sage.py | sha256=NWzvMNs3h-Ps0Ro-xZhDpH2yDunVqRVLOG04fbwtwGQ | 829 |
| ase/visualize/x3d.py | sha256=I_9bOOyl7KDAxezh27B7Gme2r6DBXevbEyhzTBOmF1I | 519 |
| ase-3.22.1.dist-info/COPYING | sha256=gXf5dRMhNSbfLPYYTY_5hsZ1r7UU1OaKQEAQUhuIBkM | 18092 |
| ase-3.22.1.dist-info/COPYING.LESSER | sha256=3GJlINzVOiL3J68-5Cx3DlbJemT-OtsGN5nYqwMv5VE | 26530 |
| ase-3.22.1.dist-info/LICENSE | sha256=IddSAlCFfSSt8Pv4DgHJZti64qLXl_FMwDi68jfP5Zk | 608 |
| ase-3.22.1.dist-info/METADATA | sha256=9m2N37fHjKXtl5RdrMQeyt6leGUEpUUP2MHmsKYOS4M | 3134 |
| ase-3.22.1.dist-info/WHEEL | sha256=_NOXIqFgOaYmlm9RJLPQZ13BJuEIrp5jx5ptRD5uh3Y | 92 |
| ase-3.22.1.dist-info/entry_points.txt | sha256=9UpYol6bl66pdYVJNtzjWTXdTIhVXJIBVWKrsguNZNo | 180 |
| ase-3.22.1.dist-info/top_level.txt | sha256=5g9TnxOI8fLqHg8jHSmebm4dVFAjEA30k95UTEaA-5c | 4 |
| ase-3.22.1.dist-info/RECORD | — | — |
top_level.txt
ase
entry_points.txt
ase = ase.cli.main:main
ase-build = ase.cli.main:old
ase-db = ase.cli.main:old
ase-gui = ase.cli.main:old
ase-info = ase.cli.main:old
ase-run = ase.cli.main:old