Category:計算化学ソフトウェア

Ribbon diagram

Avogadro (software)

MOPAC

Scigress

Gaussian (software)

AMPAC

Dirac (software)

GAMESS

Amsterdam Density Functional

CP2K

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

TURBOMOLE

Spartan (chemistry software)

ABINIT

CHELPG