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pydft
|
public |
Python package for performing simple DFT calculations
|
2024-12-15 |
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pypwdft
|
public |
Python package for performing simple DFT calculations
|
2024-09-30 |
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pyqint
|
public |
Python package for evaluating integrals of Gaussian type orbitals in electronic structure calculations
|
2024-09-14 |
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quantumsculpt
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public |
Python package for obtainin Lebedev quadrature integration points and weights
|
2024-02-17 |
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pylebedev
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public |
Python package for obtainin Lebedev quadrature integration points and weights
|
2023-12-22 |
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pytessel
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public |
Python package for building isosurfaces from 3D scalar fields
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2023-12-10 |
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sphecerix
|
public |
Python package for constructing Wigner-D matrices
|
2023-06-29 |
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pyvwr
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public |
Python package for extracting Kohn-Sham wave function from WAVECARS
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2023-06-18 |
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pymdlj
|
public |
Python package for performing molecular dynamics simulations using Lennard-Jones potentials
|
2023-06-16 |
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ppmil
|
public |
Pure Python Molecular Integral Library
|
2023-06-14 |
