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Physical Chemistry

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Theoretical and Computational Chemistry

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static correlation

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4 results in Keywords: static correlation

Theoretical and Computational Chemistry

Approximate Functionals for Multistate Density Functional Theory

Alexander Humeniuk

Version 1 posted 15 March 2024

247

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Theoretical and Computational Chemistry

Small-occupation density functional correlation energy correction to wavefunction approximations

José Aarón Rodríguez-Jiménez, Abel Carreras, David Casanova

Version 1 posted 04 October 2023

212

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Theoretical and Computational Chemistry

Hole-Hole Tamm-Dancoff-Approximated Density Functional Theory: A Highly Efficient Electronic Structure Method Incorporating Dynamic and Static Correlation

Christoph Bannwarth, Jimmy K. Yu, Edward G. Hohenstein, Todd J. Martínez

Version 2 posted 18 June 2020

1,233

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Theoretical and Computational Chemistry

Capturing Static and Dynamic Correlation with ΔNO-MP2 and ΔNO-CCSD

joshua wallace hollett, Pierre-Francois Loos

Version 1 posted 28 August 2019

728

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