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molsturm

swMATH ID: 33446
Software Authors: M. F. Herbst, A. Dreuw, J. E. Avery
Description: molsturm: Towards quantum-chemical method development for arbitrary basis functions. molsturm is a modular electronic structure theory program, which tries to employ concepts like lazy matrices and orthogonal programming to achieve a versatile structure. Our motto is flexibility first, but speed second, even though we are probably very far from either of the two still.
Homepage: https://github.com/molsturm/molsturm/
Source Code:  https://github.com/molsturm/molsturm/
Related Software: adcc; VeloxChem; OpenFermion; PyFLOSIC; OpenQEMIST; SciPy; NumPy; CPPE; PyBerny; libdftd3; QSoME; TBLIS; PyMBE; PyQMC; SCFInitialGuess; QISKit; Python; PySCF; cross2D; CRYSCOR
Cited in: 1 Publication

Cited in 1 Serial

1 Oberwolfach Reports

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