Category:計算化学ソフトウェア
Gaussian
Gaussian (software)
Avogadro
Avogadro (software)
HyperChem
リボンダイアグラム
Ribbon diagram
CP2K
CP2K
Scigress
ScigressSpartan
Spartan (chemistry software)ATOMCI
ABINIT
ABINITNTChem
AMPAC
AMPACDIRAC
Dirac (software)GAMESS
GAMESS
TANPAKU
Amsterdam Density Functional
Amsterdam Density Functional
CRYSTAL (ソフトウェア)
CRYSTAL (software)
Firefly (プログラム)
Firefly (computer program)
GAMESS (UK)
GAMESS (UK)
GAMESS (US)
GAMESS (US)
Open Babel
Open Babel
ORCA (量子化学プログラム)
ORCA (quantum chemistry program)PAICS
PSI (ソフトウェア)
PSI (computational chemistry)
Quantum ESPRESSO
Quantum ESPRESSOVienna Ab initio Simulation Package
Vienna Ab initio Simulation PackageTURBOMOLE
TURBOMOLECHELPG
CHELPGMOPAC
MOPAC