Real-time nuclear-electronic orbital time-dependent density functional theory with a constrained traveling proton basis.

Boyer NJ, Hammes-Schiffer S

DOI: 10.1063/5.0345226
Published: 2026 Sep 7
Container: The Journal of chemical physics
Publisher: Not recorded
Open access: unknown

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Cite this work

BibTeX

@article{allodium:10.1063/5.0345226,
  title = {Real-time nuclear-electronic orbital time-dependent density functional theory with a constrained traveling proton basis.},
  author = {Boyer NJ and Hammes-Schiffer S},
  year = {2026},
  journal = {The Journal of chemical physics},
  doi = {10.1063/5.0345226},
  url = {https://doi.org/10.1063/5.0345226}
}

RIS

TY  - JOUR
TI  - Real-time nuclear-electronic orbital time-dependent density functional theory with a constrained traveling proton basis.
AU  - Boyer NJ
AU  - Hammes-Schiffer S
PY  - 2026
JO  - The Journal of chemical physics
DO  - 10.1063/5.0345226
UR  - https://doi.org/10.1063/5.0345226
ER  -

APA

NJ, B., & S, H. (2026). Real-time nuclear-electronic orbital time-dependent density functional theory with a constrained traveling proton basis.. The Journal of chemical physics. https://doi.org/10.1063/5.0345226

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pubmed · retrieved 2026-09-25T06:38:48.187Z