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Molecular dynamics
Carrier concentration
6
Electronic density
5
A-density
4
Acid-base equilibria
4
Atomic coordinate
4
Car-Parrinello molecular dynamics simulations
4
Car-Parrinello simulation
4
Chemical bonds
4
Computational costs
4
Constant of motion
4
Continuum mechanics
4
Continuum model
4
Continuum solvents
4
Density functional theory
4
Dielectric functions
4
Dielectric medium
4
Dynamics
4
Electron-density topology
4
Electronic structure
4
Electronic structure calculations
4
Experimental research
4
First-principles
4
Integration
4
Interfacial region
4
Kohn-Sham potential
4
Liquids
4
Molecular dynamics simulations
4
Molecular mechanism
4
Molecular systems
4
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1Materias: “...Inhomogeneous electronic density...”
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2Materias: “...Inhomogeneous electronic density...”
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3por Ruiz Tobon, Carlos MarioMaterias: “...Electronic density...”
Publicado 2016
Aportado por: Biblioteca Virtual - Tesis (UNL)Tesis doctoral acceptedVersion SNRD -
4
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5Materias: “...Electronic density of states...”
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6
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7Materias: “...Electron-density topology...”
Artículo publishedVersion -
8Materias: “...Electron-density topology...”
Artículo publishedVersion -
9Materias: “...Electron-density topology...”
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10Materias: “...Electronic density...”
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11Materias: “...Electronic density...”
Artículo publishedVersion -
12Materias: “...Electronic density...”
Artículo publishedVersion -
13Materias: “...Electronic density...”
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14Publicado 2018Materias: “...Electron density profiles...”
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15Materias: “...Electron density profiles...”
JOUR