Self-Consistent Equations Including Exchange and Correlation Effects - Test2 - elhamkhani - TriplyDB

Self-Consistent Equations Including Exchange and Correlation Effects

Self-Consistent Equations Including Exchange and Correlation Effects

http://www.wikidata.org/entity/Q25939002

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Theoretical approaches to x-ray absorption fine structure Theory of ferromagnetic (III,Mn)V semiconductors High Pressure Behavior of Silicon Clathrates: A New Class of Low Compressibility Materials Prediction of the material with highest known melting point from ab initio molecular dynamics calculations Anharmonic vibrational properties in periodic systems: energy, electron-phonon coupling, and stress First-principles calculation of the structural stability of 6 d transition metals Ab initio study of superconducting hexagonal Be 2 Li under pressure Elasticity and piezoelectricity of zinc oxide crystals, single layers, and possible single-walled nanotubes Adhesion, atomic structure, and bonding at the Al ( 111 ) / α − Al 2 O 3 ( 0001 ) interface: A first principles study Structure and magnetic properties of Fe-Ni clusters Electronic structure of BAs and boride III-V alloys Systematic ab initio study of the electronic and magnetic properties of different pure and mixed iron systems Compression mechanisms in quasimolecular X I 3 ( X = A s , S b , B i ) solids Structure, dynamics, and electronic structure of liquid Ag-Se alloys investigated by ab initio simulation Properties of B 2 O: An unsymmetrical analog of carbon Electronic structure and scanning-tunneling-microscopy image of molybdenum dichalcogenide surfaces Ab initio study of piezoelectricity and spontaneous polarization in ZnO First-principles calculation of the magnetocrystalline anisotropy energy of iron, cobalt, and nickel Good semiconductor band gaps with a modified local-density approximation Theory of Metal Surfaces: Work Function Nonlinear ionic pseudopotentials in spin-density-functional calculations Optimized Lieb-Oxford bound for the exchange-correlation energy Hydrogen as a Cause of Doping in Zinc Oxide Shape coexistence and triaxiality in the superheavy nuclei Photocatalytic Water Splitting-The Untamed Dream: A Review of Recent Advances Small Atomic Orbital Basis Set First-Principles Quantum Chemical Methods for Large Molecular and Periodic Systems: A Critical Analysis of Error Sources Applications of the Conceptual Density Functional Theory Indices to Organic Chemistry Reactivity Molecular Theory of Detonation Initiation: Insight from First Principles Modeling of the Decomposition Mechanisms of Organic Nitro Energetic Materials QM/MM molecular dynamics studies of metal binding proteins Fast and Accurate Modeling of Molecular Atomization Energies with Machine Learning Strain induced topological phase transitions in monolayer honeycomb structures of group-V binary compounds Stability of rhombohedral phases in vanadium at high-pressure and high-temperature: first-principles investigations.Selective condensation of DNA by aminoglycoside antibiotics Density-functional theory of the correlation energy in atoms and ions: A simple analytic model and a challenge Theoretical calculations of heterojunction discontinuities in the Si/Ge system New Metallic Carbon Crystal Hohenberg-Kohn theorem for time-dependent ensembles.Density-functional theory for time-dependent systems Density-functional theory of many-electron systems subjected to time-dependent electric and magnetic fields Ab initio theory of gate induced gaps in graphene bilayers

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Self-Consistent Equations Including Exchange and Correlation Effects

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1965 nî lūn-bûn

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1965 թուականի Նոյեմբերին հրատարակուած գիտական յօդուած

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1965 թվականի նոյեմբերին հրատարակված գիտական հոդված

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1965年の論文

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Self-Consistent Equations Including Exchange and Correlation Effects

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Kohn–Sham equations