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Found 18 Software Packages (Results 1–18)

AiiDA

Software Authors:   Giovanni Pizzi, Andrea Cepellotti, Riccardo Sabatini, Nicola Marzari, Boris Kozinsky
Referenced in: 1 Publication (2022)
Related Software: FireWorks; AFLOW; Python; ASE; pymatgen; MyQueue; …
Main Fields: Partial differential equations (35-XX); Numerical analysis (65-XX); Quantum theory (81-XX)

SpaceGroupIrep

Software Authors:   Gui-Bin Liu, Miao Chu, Zeying Zhang, Zhi-Ming Yu, Yugui Yao
Referenced in: 1 Publication (2010)
Related Software: ISOTROPY; ABINIT; Quantum Espresso; Mathematica; PythTB; Z2pack; …
Main Fields: Group theory and generalizations (20-XX); Geometry (51-XX); Quantum theory (81-XX)

ELATE

Software Authors:   Romain Gaillac, Pluton Pullumbi, François-Xavier Coudert
Referenced in: 1 Publication (2018)
Related Software: Bottle; Plotly; JSXGraph; ElaStic; Python; Mathematica; …
Main Fields: Numerical analysis (65-XX); Mechanics of deformable solids (74-XX)

SUePDF

Software Authors:   D. T. Tran, G. Svensson, C.-W. Tai
Referenced in: 0 Publications
Related Software: RDFTools; Matlab; eRDF Analyser; EDDA
Main Fields:

ASR

Software Authors:   Morten Gjerding, Thorbjørn Skovhus, Asbjørn Rasmussen, Fabian Bertoldo, Ask Hjorth Larsen, Jens Jørgen Mortensen, Kristian Sommer Thygesen
Referenced in: 0 Publications
Related Software: ASE; GPAW; MyQueue; Phonopy; Spglib; pymatgen; …
Main Fields:

COMBIgor

Software Authors:   Kevin R. Talley, Sage R. Bauers, Celeste L. Melamed, Meagan C. Papac, Karen Heinselman, Imran Khan, Dennice M. Roberts, Valerie Jacobson, Allison Mis, Geoff L. Brennecka, John D. Perkins, Andriy Zakutayev
Referenced in: 0 Publications
Related Software: IGOR Pro
Main Fields:

EZFF

Software Authors:   Aravind Krishnamoorthy, Ankit Mishra, Deepak Kamal, Sungwook Hong, Ken-ichi Nomura, Subodh Tiwari, Aiichiro Nakano, Rajiv Kalia, Rampi Ramprasad, Priya Vashishta
Referenced in: 0 Publications
Related Software: Python; ReaxFF; Paramfit; mpi4py; xtal; Platypus; …
Main Fields:

hiPhive

Software Authors:   Fredrik Eriksson, Erik Fransson, Paul Erhart
Referenced in: 0 Publications
Related Software: Scikit; AAPL; almaBTE; ShengBTE; phono3py; dynasor; …
Main Fields:

MagneticTB

Software Authors:   Zeying Zhang, Zhi-Ming Yu, Gui-Bin Liu, Yugui Yao
Referenced in: 0 Publications
Related Software: PythTB; Z2pack; ISOTROPY; SpaceGroupIrep; WannierTools; Qsymm; …
Main Fields:

ML4Chem

Software Authors:   Muammar El Khatib, Wibe A de Jong
Referenced in: 0 Publications
Related Software: Amp; Matplotlib; Adam; Scikit; DScribe; pymatgen; …
Main Fields:

MPInterfaces

Software Authors:   Kiran Mathew, Arunima K. Singh, Joshua J. Gabriel, Kamal Choudhary, Susan B. Sinnott, Albert V. Davydov, Francesca Tavazza, Richard G. Hennig
Referenced in: 0 Publications
Related Software: VASP; VASPsol; pymatgen; Python
Main Fields:

orix

Software Authors:   Duncan N. Johnstone, Ben H. Martineau, Phillip Crout, Paul A. Midgley, Alexander S. Eggeman
Referenced in: 0 Publications
Related Software: MTEX; Scikit; Matplotlib; SciPy; NumPy; Python
Main Fields:

phq

Software Authors:   Zhen Zhang, Dong-Bo Zhang, Tao Sun, Renata Wentzcovitch
Referenced in: 0 Publications
Related Software: PHONON; PHON; LAMMPS; ABINIT; VASP; Quantum Espresso
Main Fields:

PyCDFT

Software Authors:   He Ma, Wennie Wang, Siyoung Kim, Man-Hin Cheng, Marco Govoni, Giulia Galli
Referenced in: 0 Publications
Related Software: CP2K; Quantum Espresso; pyFFTW; SciPy; ASE; Atomate; …
Main Fields:

PyCraters

Software Authors:   Scott A. Norris
Referenced in: 0 Publications
Related Software: SDTrimSP; Tridyn; LAMMPS; Python
Main Fields:

PyIVA

Software Authors:   Austin Kim, Zois Boukouvalas, Daniel C. Elton
Referenced in: 0 Publications
Related Software: Molecular Machine Learning Toolkit; iva_laplace; Rdkit; GitHub; Python
Main Fields:

PyXtal

Software Authors:   Scott Fredericks, Dean Sayre, Qiang Zhu
Referenced in: 0 Publications
Related Software: ASE; Spglib; pymatgen; pandas; SciPy; NumPy; …
Main Fields:

RHEOS.jl

Software Authors:   J L Kaplan, A Bonfanti, A Kabla
Referenced in: 0 Publications
Related Software: bob-rheology; ForceMetric; NLopt; Julia
Main Fields: