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Author:
Andrea Petrocchi, Swapneel Amit Pathak, Martin Lang, Sam Holt, Hans Fangohr
Summary:
Density functional theory (DFT) methods package for ab-initio calculations.
Latest version:
0.5.0
Required dependencies:
ase
|
mammos-entity
|
mammos-units
|
pandas
|
pydantic
|
rich
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