Category:計算化学ソフトウェア

Ribbon diagram

MOPAC

CP2K

Avogadro (software)

Scigress

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

TURBOMOLE

ABINIT

Spartan (chemistry software)

CHELPG

Gabedit