Systematic Molecularity-Dependent Entropy Errors in Continuum/RRHO Solution Thermochemistry: Origin and Correction.

Rebollar-Zepeda A, Carreon-Gonzalez M, Muñoz-Rugeles L, Alvarez-Idaboy JR

DOI: 10.1021/acs.jctc.6c00575
Published: 2026 Jul 14
Container: Journal of chemical theory and computation
Publisher: Not recorded
Open access: yes

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Cite this work

BibTeX

@article{allodium:10.1021/acs.jctc.6c00575,
  title = {Systematic Molecularity-Dependent Entropy Errors in Continuum/RRHO Solution Thermochemistry: Origin and Correction.},
  author = {Rebollar-Zepeda A and Carreon-Gonzalez M and Muñoz-Rugeles L and Alvarez-Idaboy JR},
  year = {2026},
  journal = {Journal of chemical theory and computation},
  doi = {10.1021/acs.jctc.6c00575},
  url = {https://doi.org/10.1021/acs.jctc.6c00575}
}

RIS

TY  - JOUR
TI  - Systematic Molecularity-Dependent Entropy Errors in Continuum/RRHO Solution Thermochemistry: Origin and Correction.
AU  - Rebollar-Zepeda A
AU  - Carreon-Gonzalez M
AU  - Muñoz-Rugeles L
AU  - Alvarez-Idaboy JR
PY  - 2026
JO  - Journal of chemical theory and computation
DO  - 10.1021/acs.jctc.6c00575
UR  - https://doi.org/10.1021/acs.jctc.6c00575
ER  -

APA

A, R., M, C., L, M., & JR, A. (2026). Systematic Molecularity-Dependent Entropy Errors in Continuum/RRHO Solution Thermochemistry: Origin and Correction.. Journal of chemical theory and computation. https://doi.org/10.1021/acs.jctc.6c00575

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pubmed · retrieved 2026-11-10T10:10:39.969Z