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Density functional theory
8
Density functional theory calculations
4
A. Ceria
2
A. Diluted magnetic oxides
2
Ag(111) surface
2
Ammonia
2
Ammonia molecules
2
Atoms
2
Ce 4f state
2
Cerium
2
Cerium compounds
2
Cerium oxides
2
Charge localization
2
Chemical bonds
2
Chemical shielding
2
Chemical shift
2
Classical molecular dynamics
2
Co-doped
2
Cobalt
2
Cobalt atoms
2
Coherent addition
2
Computer simulation
2
D. Charge localization
2
DFT Calculations
2
Degree of decomposition
2
Density Functional Theory Calculations
2
Density-functional theory calculations
2
Deoxygenations
2
Deuterated liquids
2
Deuterium
2
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1por Illicachi, Luis Alberto, Montalvo-Acosta, Joel José, Insuasty, Alberto, Quiroga, Jairo, Abonia, Rodrigo, Sortino, Maximiliano, Zacchino, Susana, Insuasty, BraulioMaterias: “...Density Functional Theory Calculations...”
Publicado 2020
article artículo publishedVersion -
2Materias: “...Density Functional Theory Calculations...”
article artículo publishedVersion -
3Materias: “...Time dependent density functional theory calculations...”
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4Materias: “...Time dependent density functional theory calculations...”
JOUR -
5Materias: “...Density-functional theory calculations...”
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6Materias: “...Density-functional theory calculations...”
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7por Murgida, Gustavo Ezequiel, Vildosola, Verónica L., Ferrari, Valeria Paola, Llois, Ana MaríaMaterias: “...Density functional theory calculations...”
Publicado 2012
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8Materias: “...Density functional theory calculations...”
JOUR -
9Publicado 2009Materias: “...Density functional theory calculations...”
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10Materias: “...Density functional theory calculations...”
JOUR