Category:計算化学ソフトウェア

Gaussian (software)

MOPAC

Ribbon diagram

Winmostar

TURBOMOLE

ABINIT

Spartan (chemistry software)

CP2K

AMPAC

Dirac (software)

GAMESS

Amsterdam Density Functional

CRYSTAL (software)

Firefly (computer program)

GAMESS (UK)

GAMESS (US)

Open Babel

ORCA (quantum chemistry program)

PSI (computational chemistry)

Quantum ESPRESSO

Vienna Ab initio Simulation Package

CHELPG

Gabedit