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Optimizing the regularization in size-consistent second-order Brillouin-Wigner perturbation theory

The Journal of Chemical Physics(2023)10.1063/5.0174923Source: DataRank Database

Optimizing the regularization in size-consistent second-order Brillouin-Wigner perturbation theory is a research paper published in The Journal of Chemical Physics (2023). On theSindex it has a DataRank of 0. It has been cited 18 times.

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Open Access18 citations

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›Methodology & internals

datarank_citation_only_1hop_v6· scope data_onlyMethodology

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Enrichment:Funding (3 grants)Impact (FWCI 1.50)OA: bronzeTopics (34)IDs (PubMed, PMC, OpenAlex)SDGs (1)

FAIR Checklist

Context only (not used in score)

Findable (1/2)

Has DOI

Accessible (1/2)

Open Access

Interoperable (0/2)

Reusable (0/3)

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Authors (3)

James Shee ORCID,Martin Head‐Gordon ORCID,Kevin Carter-Fenk ORCID

Live enrichment

PubMed:37933781 PMC:PMC10752296 OpenAlex:https://openalex.org/W4388455404

U.S. Department of Energy

Grant: DE-AC02-05CH11231

National Institutes of Health

Grant: F32GM149165

National Institutes of Health

Grant: 1F32GM149165-01

Towards a Quantum-Mechanical Understanding of Redox Chemistry in Proteins

FWCI

1.50

Citation Percentile

0.8%

Citation Trend

2024

2025

2026

bronzeLicense: CC BY

journalhttps://pubs.aip.org/aip/jcp/article-pdf/doi/10.1063/5.0174923/18269418/171104_1_5.0174923.pdf

publisherhttps://pubs.aip.org/aip/jcp/article-pdf/doi/10.1063/5.0174923/18269418/171104_1_5.0174923.pdf

publisherhttps://pubs.aip.org/aip/jcp/article-pdf/doi/10.1063/5.0174923/19665283/171104_1_5.0174923.pdf

journalhttps://doi.org/10.1063/5.0174923

repositoryhttps://pubmed.ncbi.nlm.nih.gov/37933781

Fields of Study

Molecular Junctions and NanostructuresSpectroscopy and Quantum Chemical StudiesPhotochemistry and Electron Transfer Studies01 natural sciences0103 physical sciences

Keywords

Basis setThermochemistryRegularization (linguistics)Statistical physicsAmplitudeMøller–Plesset perturbation theoryScalingAb initioPhysicsChemistryQuantum mechanicsComputational chemistryPerturbation theory (quantum mechanics)MathematicsDensity functional theoryThermodynamicsComputer scienceChemical Physics (physics.chem-ph)Chemical Physics500FOS: Physical sciences540Physical ChemistryPhysical sciencesCSD-04-GPCP-AEngineeringChemical sciencesTheoretical and Computational ChemistryPhysics - Chemical Physics

Sustainable Development Goals

SDG 0: Affordable and clean energy