Wheelodex » Projects » fhi-aims-step

fhi-aims-step

View on PyPI — Reverse Dependencies (0)

2024.1.19 fhi_aims_step-2024.1.19-py2.py3-none-any.whl

Wheel Details

Project: fhi-aims-step
Version: 2024.1.19
Filename: fhi_aims_step-2024.1.19-py2.py3-none-any.whl
Download: [link]
Size: 49248
MD5: 87a3cd88fb1d8aa624bcdfc03875ca49
SHA256: 18a1be07420d3d1f2b7212a9e1b47097690b68f62269a56bf306473d01375dfd
Uploaded: 2024-01-19 20:35:50 +0000

dist-info

METADATA · WHEEL · RECORD · top_level.txt · entry_points.txt · zip-safe

METADATA

Metadata-Version: 2.1
Name: fhi_aims_step
Version: 2024.1.19
Summary: A SEAMM plug-in for FHI-aims
Author: Paul Saxe
Author-Email: psaxe[at]molssi.org
Home-Page: https://github.com/molssi-seamm/fhi_aims_step
License: BSD-3-Clause
Keywords: SEAMM,SEAMMplugin,flowchart
Classifier: Environment :: Plugins
Classifier: Development Status :: 2 - Pre-Alpha
Classifier: Intended Audience :: Science/Research
Classifier: Topic :: Scientific/Engineering :: Chemistry
Classifier: Topic :: Scientific/Engineering :: Physics
Classifier: License :: OSI Approved :: BSD License
Classifier: Natural Language :: English
Classifier: Programming Language :: Python :: 3 :: Only
Classifier: Programming Language :: Python :: 3.8
Classifier: Programming Language :: Python :: 3.9
Platform: Linux
Platform: Mac OS-X
Platform: Unix
Platform: Windows
Requires-Dist: seamm
Requires-Dist: seamm-exec
Requires-Dist: seamm-util
Requires-Dist: seamm-widgets
Description-Content-Type: text/x-rst
License-File: LICENSE
License-File: AUTHORS.rst
[Description omitted; length: 2295 characters]

WHEEL

Wheel-Version: 1.0
Generator: bdist_wheel (0.42.0)
Root-Is-Purelib: true
Tag: py2-none-any
Tag: py3-none-any

RECORD

Path Digest Size
fhi_aims_step/__init__.py sha256=TYezKOT_xpvUn4FmcP08NftYwQ4FEbeXcnD8acc8Kls 1138
fhi_aims_step/_version.py sha256=rp0Tndw4xayvaKfj4oEIlC_ZLY1GCmpgvuvHKgXQrkc 501
fhi_aims_step/energy.py sha256=Akm3ZDmWt9Q9j-KvGiMi-7dGBzrIrqC_Sy3uCyHfxUI 27547
fhi_aims_step/energy_parameters.py sha256=M7yiCyj2LBCU_Uv_H-iQTZrZ3NTYbk_ypCLqBNelZdo 18525
fhi_aims_step/energy_step.py sha256=0J7utMrWwRPxObCZHfVw-zIKT8RZaYmfZpHu-3o2weQ 3029
fhi_aims_step/fhi_aims.py sha256=ebFufgDqU2V0jgCNgZ23r3hrMid6OEXy_qUio2GAT1Y 9121
fhi_aims_step/fhi_aims_parameters.py sha256=E3TSQeW5UuF8tzGKMHHRH8U1jwAVMjM1nzdAH-8KpTE 3840
fhi_aims_step/fhi_aims_step.py sha256=SrmitUbkNf9EabYumUlxFPSpxnUT7r-AdmuUyDcYSlE 3026
fhi_aims_step/metadata.py sha256=AZFsofwc4JiIOUzzBAIOxvTPA_wdtPr9xuXmiiy-7MI 24311
fhi_aims_step/optimization.py sha256=yXZMHGGUqupQyu5IH6FN4HCqFW4Bwgyp50jT2HwvUNQ 13814
fhi_aims_step/optimization_parameters.py sha256=SDzzAaKXgOz68jo7b85xJDZpwf21IH7Jsjg9RpHp904 4733
fhi_aims_step/optimization_step.py sha256=7jyKmewlmSvcBnLm95n7dTM-mIUoEq94f8X91tTQEcg 3083
fhi_aims_step/substep.py sha256=7OKlMgTd1NPf1uzrGUh2l7KB31SlWJ9yROYBGkGUIyw 13815
fhi_aims_step/tk_energy.py sha256=mF6S37C_Nuhng6QNt2Ul0MaGxzc9ZuFiO7nrD9kpgyM 18130
fhi_aims_step/tk_fhi_aims.py sha256=bywUdiU04kgei0e3vo_y9NZQyd9xeDuuf4uQv1VPx0o 3750
fhi_aims_step/tk_optimization.py sha256=o7dXSPN4i4N1eIeyq4tpWaszFtDxqIuwCyOEm90TPh4 5516
fhi_aims_step/data/configuration.txt sha256=_hQ7Cn7mxwthg22FEChpLPbZfUIbeLJ-K_RUF2mWVVw 2396
fhi_aims_step/data/properties.csv sha256=P_kMruAM9frZOpiWg0MZdhA7TU6Sll-nsqCpZ-xagkY 126
fhi_aims_step/data/references.bib sha256=cgw9ITm7hpuQ7ABkFmm6ziJB8HN2E3MO5NLr7KCEEGI 3577
fhi_aims_step-2024.1.19.dist-info/AUTHORS.rst sha256=HKy1QAUcENUPZZIAeLClJTLLQ0m438MWROo7bvLs41Q 126
fhi_aims_step-2024.1.19.dist-info/LICENSE sha256=rqT5rYaXVBcrsorOT61AaE8Aj3-gGnqf5vHslZSk9EE 1519
fhi_aims_step-2024.1.19.dist-info/METADATA sha256=0muT3QDOfwm4gSGyin3zRFHKJdpzHCfIek_etvijQ8g 3308
fhi_aims_step-2024.1.19.dist-info/WHEEL sha256=-G_t0oGuE7UD0DrSpVZnq1hHMBV9DD2XkS5v7XpmTnk 110
fhi_aims_step-2024.1.19.dist-info/entry_points.txt sha256=AhPxh_Fzhkie4EySZD5yWNKuyYtVQJaTyffRFn4UYW0 337
fhi_aims_step-2024.1.19.dist-info/top_level.txt sha256=xOWB_nRx34ry8ZEUXJymB8hchtNKij0VJXx0Vb1sFqg 14
fhi_aims_step-2024.1.19.dist-info/zip-safe sha256=AbpHGcgLb-kRsJGnwFEktk7uzpZOCcBY74-YBdrKVGs 1
fhi_aims_step-2024.1.19.dist-info/RECORD — —

top_level.txt

fhi_aims_step

entry_points.txt

[org.molssi.seamm]
FHI-aims = fhi_aims_step:FHIaimsStep
[org.molssi.seamm.fhi_aims]
Energy = fhi_aims_step:EnergyStep
Optimization = fhi_aims_step:OptimizationStep
[org.molssi.seamm.fhi_aims.tk]
Energy = fhi_aims_step:EnergyStep
Optimization = fhi_aims_step:OptimizationStep
[org.molssi.seamm.tk]
FHI-aims = fhi_aims_step:FHIaimsStep

zip-safe