Localized Hartree product treatment of multiple protons in the nuclear-electronic orbital framework.

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Incorporating nuclear vibrational energies into the "atom in molecules" analysis: An analytical study.The two-component quantum theory of atoms in molecules (TC-QTAIM): foundations

P2860

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Localized Hartree product treatment of multiple protons in the nuclear-electronic orbital framework.

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http://www.wikidata.org/entity/Q43146286

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2010 nî lūn-bûn

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2010年の論文

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2010年学术文章

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2010年学术文章

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2010年学术文章

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2010年学术文章

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name

Localized Hartree product trea ...... -electronic orbital framework.

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Localized Hartree product trea ...... -electronic orbital framework.

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Item

label

Localized Hartree product trea ...... -electronic orbital framework.

@en

Localized Hartree product trea ...... -electronic orbital framework.

@nl

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Localized Hartree product trea ...... -electronic orbital framework.

@en

Localized Hartree product trea ...... -electronic orbital framework.

@nl

P1476

Localized Hartree product trea ...... -electronic orbital framework.

@en

P2093

Benjamin Auer

http://www.w3.org/2001/XMLSchema#string

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Development of the Colle-Salvetti correlation-energy formula into a functional of the electron density

Density-functional thermochemistry. III. The role of exact exchange

Self‐Consistent Molecular‐Orbital Methods. IX. An Extended Gaussian‐Type Basis for Molecular‐Orbital Studies of Organic Molecules

The importance of three-body terms in the fragment molecular orbital method.

Self‐consistent molecular orbital methods. XXIII. A polarization‐type basis set for second‐row elements

Properties of the exact universal functional in multicomponent density functional theory.

Density matrix formulation of the nuclear-electronic orbital approach with explicit electron-proton correlation.

Nuclear-electronic orbital nonorthogonal configuration interaction approach.

Electron-proton correlation for hydrogen tunneling systems.

The Wave Mechanics of an Atom with a Non-Coulomb Central Field. Part I. Theory and Methods

P304

084110

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scholarly article

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10.1063/1.3332769

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P407

English

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P478

132

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P50

Sharon Hammes-Schiffer

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2010-02-01T00:00:00Z

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41654436

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P698

20192293

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Localized Hartree product treatment of multiple protons in the nuclear-electronic orbital framework.

about

P2860

P2860

Localized Hartree product treatment of multiple protons in the nuclear-electronic orbital framework.

description

name

type

label

prefLabel

P1433

P1476

P2093

P2860

P304

P31

P356

P407

P433

P478

P50

P577

P5875

P698

P356

P1433

P1476

P2093

P2860

P304

P31

P356

P407

P433

P478

P50

P577

P5875

P698