Materias dentro de su búsqueda.
Materias dentro de su búsqueda.
Molecular orbitals
6
Expectation values
5
Wave functions
5
Configuration interactions
4
Electron localization function
4
Natural orbitals
4
Slater determinants
4
Change of basis
3
Electrospinning
3
Magnetic moments
3
Quantitative evaluation
3
Rapid convergence
3
Unitary transformations
3
Localization algorithm
2
Localization index
2
Localization procedure
2
Molecular systems
2
Numerical results
2
Orbital localization criterion
2
Topological analysis
2
Topology
2
electron localization function
2
"fuzzy" atoms
1
Algorithms
1
Atomic orbital
1
Atomic orbitals
1
Atomic physics
1
Atoms
1
Bonding analysis
1
Boron clusters
1
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1Materias: “...localized molecular orbital...”
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2por Oña, O.B., Torres-Vega, J.J., Torre, A., Lain, L., Alcoba, D.R., Vásquez-Espinal, A., Tiznado, W.Materias: “...Localized orbitals...”
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3Materias: “...Molecular orbitals...”
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4Materias: “...Natural orbitals...”
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5Materias: “...Natural orbitals...”
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6Materias: “...Natural orbitals...”
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7Materias: “...Molecular orbital theory...”
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8Materias: “...Orbital localization criterion...”
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9Materias: “...orbital localization criterion...”
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10Materias: “...Optimization of molecular orbital basis sets...”
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11Materias: “...Identical localized orbitals...”
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12Materias: “...Atomic orbitals...”
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