Publication | Closed Access

Direct computation of second-order SCF properties of large molecules on workstation computers with an application to large carbon clusters

Cluster ScienceEngineeringPhysicsNatural SciencesPhysical ChemistryMathematical ChemistryMolecular ComputingComputational ChemistryMolecular MechanicQuantum ChemistryChemistryLarge MoleculesLarge Carbon ClustersMolecular DesignSecond-order Scf Properties