Abel Carreras

icon company Multiverse Computing icon location Donostia-San Sebastian (Spain)

Results 4 repositories owned by Abel Carreras

DynaPhoPy

107
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49
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Phonon anharmonicity analysis from molecular dynamics

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phonolammps

77
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24
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LAMMPS interface for phonon calculations using phonopy

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PyQchem

21
Stars
7
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Python interface for Q-Chem

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posym

15
Stars
4
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Point symmetry analysis tool for theoretical chemistry objects

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