Efficient Algorithms for Analytical Gradients and Nonadiabatic Couplings of Second-Order Extended Multiconfiguration Quasi-Degenerate Perturbation Theory.
- DOI
- 10.1021/acs.jctc.6c00565
- Published
- 2026 Sep 8
- Container
- Journal of chemical theory and computation
- Publisher
- Not recorded
- Open access
- unknown
Credibility signals
limited evidence Score 43/100 under policy 1.0.0. This is a metadata assessment, not a judgment of the paper's conclusions.
Show all credibility signals
- cautionDOI registered: No matching Crossref record was present in this response.
- cautionDOI resolves: No matching Crossref record was present in this response.
- not scoredDirectory of Open Access Journals: No matching DOAJ record was present in this response. No allow-list match; this is not evidence of low credibility.
- not scoredMEDLINE indexed: Not checked or no result supplied; no credibility inference made.
- not scoredOpenAlex core source: Not checked or no result supplied; no credibility inference made.
- not scoredKnown publisher allow-list: Not checked or no result supplied; no credibility inference made.
- not scoredROR affiliation: Not checked or no result supplied; no credibility inference made.
- not scoredRetraction Watch retraction: No retraction notice matched this DOI in the deployed snapshot. No matching event found; coverage may be incomplete.
- not scoredRetraction Watch expression of concern: No expression of concern notice matched this DOI in the deployed snapshot. No matching event found; coverage may be incomplete.
- not scoredRetraction Watch correction: No correction notice matched this DOI in the deployed snapshot. No matching event found; coverage may be incomplete.
- not scoredRetraction Watch reinstatement: No reinstatement notice matched this DOI in the deployed snapshot. No matching event found; coverage may be incomplete.
- not scoredOpen access status: Not checked or no result supplied; no credibility inference made.
- not scoredPublication license: Not checked or no result supplied; no credibility inference made.
- not scoredPublication version: A publication version was supplied but is not scored.
- cautionMetadata completeness: 5 of 6 scored descriptive metadata groups are present; missing fields increase uncertainty.
Cite this work
BibTeX
@article{allodium:10.1021/acs.jctc.6c00565,
title = {Efficient Algorithms for Analytical Gradients and Nonadiabatic Couplings of Second-Order Extended Multiconfiguration Quasi-Degenerate Perturbation Theory.},
author = {Bruyakin YV and Bochenkov VE and Bochenkova AV},
year = {2026},
journal = {Journal of chemical theory and computation},
doi = {10.1021/acs.jctc.6c00565},
url = {https://doi.org/10.1021/acs.jctc.6c00565}
}RIS
TY - JOUR TI - Efficient Algorithms for Analytical Gradients and Nonadiabatic Couplings of Second-Order Extended Multiconfiguration Quasi-Degenerate Perturbation Theory. AU - Bruyakin YV AU - Bochenkov VE AU - Bochenkova AV PY - 2026 JO - Journal of chemical theory and computation DO - 10.1021/acs.jctc.6c00565 UR - https://doi.org/10.1021/acs.jctc.6c00565 ER -
APA
YV, B., VE, B., & AV, B. (2026). Efficient Algorithms for Analytical Gradients and Nonadiabatic Couplings of Second-Order Extended Multiconfiguration Quasi-Degenerate Perturbation Theory.. Journal of chemical theory and computation. https://doi.org/10.1021/acs.jctc.6c00565
Source records
- pubmed · retrieved 2026-09-25T19:50:12.180Z