Works matching IS 01928651 AND DT 2024 AND VI 45 AND IP 4
Results: 6
Correction to "Terminal end‐on coordination of dinitrogen vs. isoelectronic CO: A comparison using the charge displacement analysis".
- Published in:
- Journal of Computational Chemistry, 2024, v. 45, n. 4, p. 230, doi. 10.1002/jcc.27241
- Publication type:
- Article
Self‐consistent field method for open‐shell systems within the density‐matrix functional theory.
- Published in:
- Journal of Computational Chemistry, 2024, v. 45, n. 4, p. 222, doi. 10.1002/jcc.27232
- By:
- Publication type:
- Article
Tuning ultrafast time‐evolution of photo‐induced charge‐transfer states: A real‐time electronic dynamics study in substituted indenotetracene derivatives.
- Published in:
- Journal of Computational Chemistry, 2024, v. 45, n. 4, p. 210, doi. 10.1002/jcc.27231
- By:
- Publication type:
- Article
Impact of dielectric constant of solvent on the formation of transition metal‐ammine complexes.
- Published in:
- Journal of Computational Chemistry, 2024, v. 45, n. 4, p. 204, doi. 10.1002/jcc.27230
- By:
- Publication type:
- Article
Correcting charge distribution in reduced Li‐molecule pair for computational screening of battery solvents.
- Published in:
- Journal of Computational Chemistry, 2024, v. 45, n. 4, p. 197, doi. 10.1002/jcc.27229
- By:
- Publication type:
- Article
Issue Information.
- Published in:
- Journal of Computational Chemistry, 2024, v. 45, n. 4, p. 193, doi. 10.1002/jcc.27137
- Publication type:
- Article