An improved long-range corrected hybrid exchange-correlation functional including a short-range Gaussian attenuation (LCgau-BOP). (Q50881976)

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9 January 2020

title

An improved long-range corrected hybrid exchange-correlation functional including a short-range Gaussian attenuation (LCgau-BOP) (English)

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9 January 2020

5

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9 January 2020

author name string

Jong-Won Song

1

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9 January 2020

Seiken Tokura

2

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9 January 2020

Takeshi Sato

3

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9 January 2020

Mark A Watson

4

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9 January 2020

language of work or name

English

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publication date

1 October 2007

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Journal of Chemical Physics

9 January 2020

published in

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volume

127

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9 January 2020

issue

15

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9 January 2020

page(s)

154109

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A long-range-corrected time-dependent density functional theory.

9 January 2020

cites work

1 reference

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21 January 2018

1 reference

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21 January 2018

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Benchmark Calculations of Reaction Energies, Barrier Heights, and Transition-State Geometries for Hydrogen Abstraction from Methanol by a Hydrogen Atom

21 January 2018

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