Computational Materials Science · 2006 · 465 citations · 20 references
Natural SciencesChemistryPhysicsCondensed Matter PhysicsQuantum MechanicsThermodynamicsChemical PotentialDensity Functional TheoryEquations Of StatePerturbation TheoryTransition State TheoryElectron Correlation EnergyExchange-correlation FunctionalsGround State PropertiesGround States
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