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0.2.7 asedftk-0.2.7-py3-none-any.whl

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Project: asedftk
Version: 0.2.7
Filename: asedftk-0.2.7-py3-none-any.whl
Download: [link]
Size: 15449
MD5: acdab7d5079284e25aa0bcf53d5cf494
SHA256: f99ef4146c7a697e536c3a1437ba803a783255f895c5beb8c7c5ad0637e264e4
Uploaded: 2021-05-20 05:14:46 +0000

dist-info

METADATA · WHEEL · RECORD · top_level.txt

METADATA

Metadata-Version: 2.1
Name: asedftk
Version: 0.2.7
Summary: DFTK-based calculator for ASE
Author: Michael F. Herbst
Author-Email: info[at]michael-herbst.com
Home-Page: https://github.com/mfherbst/asedftk
License: MIT
Keywords: density-functional,theory,DFT,computational,chemistry,quantum,materials,science,electronic,structure,ab-initio,pseudopotential,analysis,ASE,DFTK
Classifier: Development Status :: 4 - Beta
Classifier: License :: OSI Approved :: MIT License
Classifier: Programming Language :: Python :: 3.6
Classifier: Programming Language :: Python :: 3.7
Classifier: Programming Language :: Python :: 3.8
Classifier: Topic :: Scientific/Engineering :: Mathematics
Classifier: Topic :: Scientific/Engineering :: Physics
Classifier: Topic :: Scientific/Engineering :: Chemistry
Requires-Python: >=3.6
Requires-Dist: ase (>=3)
Requires-Dist: numpy (>=1.14)
Description-Content-Type: text/markdown
[Description omitted; length: 2218 characters]

WHEEL

Wheel-Version: 1.0
Generator: bdist_wheel (0.36.2)
Root-Is-Purelib: true
Tag: py3-none-any

RECORD

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asedftk/juliatests.jl sha256=a2pcN5VuFitscIvbnFcTKmsXTUCh11BEeGmbtq4H4lk 8041
asedftk/precompile.jl sha256=aOnynkc6mYyJxLBddV_muovdYn66ivOZuzp1VjsFidw 636
asedftk/run_calculation.jl sha256=QoeVjTUKcQyIfjciihpFHdZTRwBkxObuFT67JOOfJ0c 9003
asedftk/test_ase_default_calculator_tests.py sha256=sjpGyfHsaQx72yinhAZM8CbJJTXR4JoS4y6Ya7Begog 3890
asedftk/test_juliatests.py sha256=vSdGJyj482TsBVhWuBhaxWgPQpkVT-hdJCq3B28ZkYM 637
asedftk/test_registering.py sha256=frnqVmjo4V_C1VcGhymUMf01L3uGdLhXkK1ZDnKXZOg 134
asedftk/test_silicon.py sha256=cJ6L3n2uqlDoR40XyRKJ912wmfHRl141ae-r7CIgxRc 580
asedftk/dftk_environment/Project.toml sha256=uWS4ppkRyQKUIqC9m853BxTZOSpkDeDpiyvg8bXcxcU 498
asedftk-0.2.7.dist-info/LICENSE sha256=mBGCCRl7WZIDUCL-w5GdFwzlyjO--EiBkOQG_qXWPHY 1074
asedftk-0.2.7.dist-info/METADATA sha256=NtIcGsAvyNal99Vfxt29GSjrCsAsgwfAwgVIBnKALf0 3139
asedftk-0.2.7.dist-info/WHEEL sha256=OqRkF0eY5GHssMorFjlbTIq072vpHpF60fIQA6lS9xA 92
asedftk-0.2.7.dist-info/top_level.txt sha256=Ojn-JAVIO9Zxacud09p5NhjCAhflwK_a1BYVnh6Lt6o 8
asedftk-0.2.7.dist-info/RECORD — —

top_level.txt

asedftk