Wheelodex » Projects » GQCConstraints

GQCConstraints

View on PyPI — Reverse Dependencies (0)

1.1.1 GQCConstraints-1.1.1-py3-none-any.whl

Wheel Details

Project: GQCConstraints
Version: 1.1.1
Filename: GQCConstraints-1.1.1-py3-none-any.whl
Download: [link]
Size: 51941
MD5: 091a69cf80b27eef58ddeac07441e85f
SHA256: 783025e3ff1d4546df984290604bd63b96486e8926389ebd8f4803c2c9b0b5d5
Uploaded: 2023-08-18 12:28:48 +0000

dist-info

METADATA · WHEEL · RECORD · top_level.txt

METADATA

Metadata-Version: 2.1
Name: GQCConstraints
Version: 1.1.1
Summary: This library build on GQCP provides easy to work with utilities in order to perform constrained quantum chemical calculations.
Author: The Ghent Quantum Chemistry Group
Keywords: quantum chemistry,constraints,GQCP
Requires-Dist: pandas (==1.2.5)
Requires-Dist: numpy (==1.22.4)
Requires-Dist: scipy (==1.7.0)
Description-Content-Type: text/markdown
License-File: LICENSE
[Description omitted; length: 1366 characters]

WHEEL

Wheel-Version: 1.0
Generator: bdist_wheel (0.41.1)
Root-Is-Purelib: true
Tag: py3-none-any

RECORD

Path Digest Size
GQCC/__init__.py sha256=p4EQSIFwU3YNLS4e6I-ojg2Lx4AKk4zsn8mx5Pwd4B4 476
GQCC/Methods/EntanglementStudy.py sha256=wqw7tuBlim0wFkspiE0JeqbkcYTC_eqvUupmAefUkJg 14704
GQCC/Methods/ExpectationValueSearch.py sha256=BycfZNCR8nnf1z4WvX-PzgpKci7t3n-lrTybCr4IHgU 10637
GQCC/Methods/MultiplierScan.py sha256=l3rP1WmWlVY31iFGpejcNmeWgdOtGmrBT7Qc__4k8Bk 5006
GQCC/Methods/PotentialEnergySurface.py sha256=IQGKT9I-PmqY4d5syJHc1k11fYam9663Mh1cJB7zoEY 6460
GQCC/Methods/__init__.py sha256=qD45lyxbWNye_85vanB6gVu28qRKmLTeGYrLevW7Llk 135
GQCC/Optimization/SpinResolvedOptimizationFunctions.py sha256=owM6BwELnyp-ky7JqeJfM0Uxc2T27rwZfNGDFOxAhA8 9867
GQCC/Optimization/SpinResolvedOptimizer.py sha256=K8ie0UBow15JQ9emVxGb7HY7pKq0EC6aUs14gTsEmf8 7567
GQCC/Optimization/SpinUnresolvedOptimizationFunctions.py sha256=V22VUqQkB3-0ipdQlMS1IfaI-CzO6WwFpzDA1Cop7EM 11774
GQCC/Optimization/SpinUnresolvedOptimizer.py sha256=p-CifRi48-DRPUXf5FKiRSSkH6JD11TEe-iRBew4azU 5825
GQCC/Optimization/__init__.py sha256=zt--fokLECN0Kr80Q79vzZIf8zVvBnQd3f2ABgXFU94 98
GQCC/SpinResolvedConstraints/FCI.py sha256=U_-3G25D_dBSpV0fNdG1sgUb35jRrtkXpNT1bArn1Vs 10191
GQCC/SpinResolvedConstraints/HubbardFCI.py sha256=k7JW8YVmWcgj0rBqxTRh7bftXAq71wJ-6cGXaonf70E 9296
GQCC/SpinResolvedConstraints/UHF.py sha256=fKaaAGyPIX_FGXSME4Aresc65VbGXYngqrNW3UUgv7Q 16591
GQCC/SpinResolvedConstraints/UNOCI.py sha256=aCCsvX8PUL55L8jimUT15eDKdMyMgpEczO80sRl_u28 10980
GQCC/SpinResolvedConstraints/__init__.py sha256=4RcjbMj8FfVK8uezDvsyBYjwWtB47snbtHYYyV_2-7k 101
GQCC/SpinUnresolvedConstraints/FCI.py sha256=Rdg0YcqODCvAY8m1ZXHBfnaHSjY4_M2BzzLIT_6mEqY 10778
GQCC/SpinUnresolvedConstraints/GHF.py sha256=PKm5xAn2f-0xcQDfMAuirmtVscYLID2h8n4pWyoDspY 14872
GQCC/SpinUnresolvedConstraints/GNOCI.py sha256=fH3fEpkJ_0XJ8Y2S_-2MHA2H4GnLANh8y5VJO9gdvp0 9502
GQCC/SpinUnresolvedConstraints/HubbardFCI.py sha256=p1btOgiM1e38bIDdLkYNWNm9iBF61LrQQJAPw9fYRPk 9073
GQCC/SpinUnresolvedConstraints/UHF.py sha256=Ai6zCtqUI37oWMBP1UtgLhAKiSanNENrNCmK2GJEdrA 19313
GQCC/SpinUnresolvedConstraints/__init__.py sha256=ycJ_q3umTeMsSVVdq_mXqcdO4Om6JsOsp-av7okBEG4 122
GQCConstraints-1.1.1.dist-info/LICENSE sha256=2n6rt7r999OuXp8iOqW9we7ORaxWncIbOwN1ILRGR2g 7651
GQCConstraints-1.1.1.dist-info/METADATA sha256=QBlTDRKzQvH4x_8yRz6QmzFMMkGeT-Tga1AVAiCgCY4 1799
GQCConstraints-1.1.1.dist-info/WHEEL sha256=5sUXSg9e4bi7lTLOHcm6QEYwO5TIF1TNbTSVFVjcJcc 92
GQCConstraints-1.1.1.dist-info/top_level.txt sha256=YN1KYIEuSj7BswxeWL9m-YYnOemkL-LWOLi8P7MONZo 5
GQCConstraints-1.1.1.dist-info/RECORD — —

top_level.txt

GQCC