Hartree fock method

d x 2 − y 2 superconductivity in a generalized Hubbard model

Physical sciences / Superconductors / Nearest Neighbor / Bose Hubbard Model / CHEMICAL SCIENCES / Energy Use / Hartree fock method / Heavy Fermion / Critical Temperature / Energy Use / Hartree fock method / Heavy Fermion / Critical Temperature

Imidazolopyrazinones as potential antioxidants

Organic Chemistry / Magnetic Resonance Spectroscopy / Antioxidants / Reactive Oxygen Species / Hartree fock method / Imidazoles / Pyrazoles / Structure activity Relationship / Superoxide Anion / Superoxides / Molecular Structure / Imidazoles / Pyrazoles / Structure activity Relationship / Superoxide Anion / Superoxides / Molecular Structure

Asymptotically adjusted self-consistent multiplicative parameter exchange-energy-functional method: Application to diatomic molecules

Density-functional theory / Mathematical Sciences / Physical sciences / Electronic Structure / CHEMICAL SCIENCES / Hartree fock method / Ionization Potential / Asymptotic Behavior / Energy function / Hartree fock method / Ionization Potential / Asymptotic Behavior / Energy function

Comparison of experimental and theoretical valence charge densities of cubic ZnSe

Materials Engineering / Condensed Matter Physics / Density-functional theory / X ray diffraction / Fourier transform / Hartree fock method / Indexation / Charge Density / Charge transfer / Ab Initio Calculation / Experimental Data / Experimental Method / Hartree fock method / Indexation / Charge Density / Charge transfer / Ab Initio Calculation / Experimental Data / Experimental Method

Phenomenological Relativistic Energy Density Functionals

High Energy Density Physics / Density-functional theory / Nuclear Energy / Nuclear Structure / Density dependence / Hartree fock method / Shell Model / Hartree fock method / Shell Model

Exchange energy functional from a Pauli correlation-factor model

Second Order / Hartree fock method / Density Matrix / Exchange Interactions / Atoms / Gradient Method
Copyright © 2017 DATOSPDF Inc.