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NCI Help
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Gadi User Guide
Using Gadi...
Software Applications Guide...
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Computational Chemistry...
Created by
Andrew Johnston
, last updated on
Mar 15, 2024
1 minute read
Computational Chemistry
ADF...
ADF 2019...
ADF 2020...
Amber...
ASE...
CP2K...
CPMD...
DALTON...
DFTB+...
DFTB+, version 20.1...
DFTB+, version 21.1...
DFTB+, version 22.2...
DFTB+, version 23.1...
DFTB+, version 24.1...
DMol3...
GA...
GAMESS...
GAMESS, Release 2019-09-R2...
GAMESS, Release 2020-06-R1...
GAMESS, Release 2020-R2...
GAMESS, Release 2021-R1...
GAMESS, Release 2021-R2 patch 1...
GAMESS, Release 2022-R2...
GAMESS, Release 2023-R1...
GAMESS, Release 2023-R2...
Gaussian...
Gaussian 16...
Gaussian 09...
GaussView 6...
GaussView 5...
GROMACS...
LAMMPS...
libint...
Libxc...
LIGGGHTS...
Molpro...
Molpro 2019...
Molpro 2020...
MRCC...
NAMD...
NBO...
NBO/6.0...
NBO/7.0...
NWChem...
OpenMolcas...
ORCA...
PSI4...
Q-Chem...
Quantum ESPRESSO...
SIESTA...
Tinker-HP...
TURBOMOLE...
VASP...
VMD...
wannier90...
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