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Found 5 Software Packages (Results 1–5)

PySCF

Software Authors:   Qiming Sun, Timothy C. Berkelbach, Nick S. Blunt, George H. Booth, Sheng Guo, Zhendong Li, Junzi Liu, James McClain, Sandeep Sharma, Sebastian Wouters, Garnet Kin-Lic Chan
Referenced in: 4 Publications (2019–2022)
Related Software: SciPy; Python; Psi4; OpenFermion; qHiPSTER; ProjectQ; …
Main Fields: Numerical analysis (65-XX); Computer science (68-XX); Quantum theory (81-XX)

DeePMD-kit

Software Authors:   Han Wang, Linfeng Zhang, Jiequn Han, Weinan E
Referenced in: 1 Publication (2021)
Related Software: TensorFlow; Adam; Slurm; dpdata; AiiDA; GAUSSIAN; …
Main Fields: Numerical analysis (65-XX); Mechanics of deformable solids (74-XX); Statistical mechanics, structure of matter (82-XX)

Tequila

Software Authors:   Jakob S. Kottmann, Sumner Alperin-Lea, Teresa Tamayo-Mendoza, Alba Cervera-Lierta, Cyrille Lavigne, Tzu-Ching Yen, Vladyslav Verteletskyi, Philipp Schleich, Abhinav Anand, Matthias Degroote, Skylar Chaney, Maha Kesibi, Naomi Grace Curnow, Brandon Solo, Georgios Tsilimigkounakis, Claudia Zendejas-Morales, Artur F. Izmaylov, Alán Aspuru-Guzik
Referenced in: 0 Publications
Related Software: SciPy; OpenFermion; QISKit; Python; pybind11; qHiPSTER; …
Main Fields:

adcc

Software Authors:   Michael F. Herbst, Maximilian Scheurer, Thomas Fransson, Dirk R. Rehn, Andreas Dreuw
Referenced in: 0 Publications
Related Software: VeloxChem; molsturm; OpenFermion; PyFLOSIC; OpenQEMIST; SciPy; …
Main Fields:

DeePKS-kit

Software Authors:   Yixiao Chen, Linfeng Zhang, Han Wang, Weinan E
Referenced in: 0 Publications
Related Software: GELUs; DP-GEN; Adam; PySCF; PyTorch
Main Fields: