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Design and application of the Meta-GGA and range-separated hybrid exchange-correlation functionals

By: Patra, BikashContributor(s): Samal, PrasanjitMaterial type: TextTextLanguage: English Publication details: Bhubaneswar: NISER, 2021. Description: xxv,119p. pbSubject(s): META-GGA | THOMAS - FERMI THEORY | HARTREE INTERACTION | SCHRODINGER EQUATION | DENSITY FUNCTIONAL THEORY (DFT) | HARTREE - FOCK (HF) THEORY | EXCHANGE - CORRELATION FUNCTIONAL | BAND GAP OF SOLID - STATE SYSTEMS | HYDROGEN HOLE DENSITY | PAULI KINETIC ENERGY DENSITYDDC classification: 530.1
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