X-ray and Electron Diffraction Study of MgO (original) (raw)

The Quantum-Topological Analysis of Electron Density in Mgo Crystal

Vladimir Tsirelson

Nihon Kessho Gakkaishi, 1995

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Local characteristics of the electronic structure of MgO: LCAO and plane-wave calculations

Ilya Tupitsyn

International Journal of Quantum Chemistry, 2005

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Study of the surface electronic structure of MgO bulk crystals and thin films

Lev Kantorovich

Surface Science, 1996

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Quantum chemical calculations of the electron center diffusion in MgO crystals

Eugene Kotomin

physica status solidi (b), 1996

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Charge Density of MgO: Implications of Precise New Measurements for Theory

Peter Rez

Physical Review Letters, 1997

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Analysis of electronic structure and X-ray absorption and emission spectra in MgO within the FP-LAPW method

Enrique González

2018

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All-electron and pseudopotential study of MgO: Equation of state, anharmonicity, and stability

Peter Dorogokupets

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Influence of Electron Correlation Effects on Bulk MgO Energetic Properties

Viorel Chihaia

Bulgarian chemical …, 2002

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The Electronic and Structural Properties of the MgO (001) Surface: Ab Initio Hartree-Fock Theory Studies

Valentin Alexiev, Viorel Chihaia

Revue Roumaine de …, 2002

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X-ray Analysis of MgO Nanoparticles by Modified Scherer’s Williamson-Hall and Size-Strain Method

ANUJ SINGH CHAUHAN

Materials Today: Proceedings, 2019

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The energetics and electronic structure of defective and irregular surfaces on MgO

Lev Kantorovich

Surface Science, 1995

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Comparison of experimental and first-principle results of band-gap narrowing of MgO nanostructures and their dependence on crystal structural parameters

NOR FADILAH CHAYED

Applied Nanoscience, 2018

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Analysis of the MgO structure factors

Pietro Cortona

Physical Review B, 1999

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Study of mechanisms of formation of X-ray emission bands in crystals by the density functional method: The Mg L 2,3 bands in metal and in MgO

Roman Ovcharenko

Optics and Spectroscopy, 2011

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Semi-empirical simulations of the electron centers in MgO crystal

Roberts Eglitis

Computational Materials Science, 1996

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Ab initio study of the cation vacancy at the surface and in bulk MgO

Philippe Baranek

Physical Chemistry Chemical Physics, 2000

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Ground and excited-state properties of M-center oxygen vacancy aggregates in the bulk and surface of MgO

David Ariza

Physical Review B - PHYS REV B, 2003

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Structure of the hydrogen stabilized MgO(111)-(1×1) surface from low energy electron diffraction (LEED)

Dilano Saldin

Surface Science, 2006

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Influence of the Basis Sets and Numerical Accuracy Control on Bulk MgO Energetic Properties. Hartree-Fock Calculations

Viorel Chihaia

Bulgarian chemical …, 2002

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XPS and AFM investigations of annealing induced surface modifications of MgO single crystals

Jatinder Yakhmi

Journal of Crystal Growth, 2002

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Local Electronic Structure Perspectives of Nanoparticle Growth: The Case of MgO

Keun Hwa Chae

ACS Omega

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Impact of annealing on the structural properties of MgO nanoparticles by XRD analysis and Rietveld refinement

Megha Jain

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V OH center in magnesium oxide: an ab initio supercell study

G M

Chemical Physics Letters, 2000

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Theoretical study of the defect distribution of trivalent cation impurities in MgO

J. Corish

Journal of Materials Science, 1988

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Mg clusters on MgO surfaces: characterization by MIES and electronic structure ab initio calculations

Lev Kantorovich

Nuclear Instruments and Methods in Physics Research Section B: Beam Interactions with Materials and Atoms, 1999

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Practical embedding for ionic materials: Crystal-adapted pseudopotentials for the MgO crystal

J. Recio

Physical Review B, 2001

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Quantum chemical simulations of the optical properties and diffusion of electron centres in mgo crystals

Eugene Kotomin

Materials Science and Engineering: B, 1996

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EXAFS AND XANES STUDIES ON THE LOCAL STRUCTURES OF METAL IONS IN METAL DOPED MgO SYSTEMS

Kiyotaka Asakura

Le Journal de Physique Colloques, 1986

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