Quantum Chemistry with GAMESS - Materials Computation Center
Quantum Chemistry with GAMESS - Materials Computation Center
Quantum Chemistry with GAMESS - Materials Computation Center
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<strong>GAMESS</strong>General Atomic and Molecular ElectronicStructure SystemGeneral purpose electronic structure codePrimary focus is on ab initio quantum chemistrycalculationsAlso can doDensity functional calculationsOther semi-empirical calculations (AM1, PM3)QM/MM calculationsIts free and in wide use on everything from laptops tosupercomputers.3