A New Reactive Force Field for NOx-Water Interactions: Development, Evaluation, and Molecular Dynamics Simulation of Peroxynitrite.

Shaban M, van Duin ACT, van Duin D, Kowalik M, Izadi ME, Weber AP, Merkert N

Open source

DOI
10.1021/acs.jpcb.6c03657
Published
2026 Oct 8
Container
The journal of physical chemistry. B
Publisher
Not recorded
Open access
yes

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BibTeX

@article{allodium:10.1021/acs.jpcb.6c03657,
  title = {A New Reactive Force Field for NOx-Water Interactions: Development, Evaluation, and Molecular Dynamics Simulation of Peroxynitrite.},
  author = {Shaban M and van Duin ACT and van Duin D and Kowalik M and Izadi ME and Weber AP and Merkert N},
  year = {2026},
  journal = {The journal of physical chemistry. B},
  doi = {10.1021/acs.jpcb.6c03657},
  url = {https://doi.org/10.1021/acs.jpcb.6c03657}
}

RIS

TY  - JOUR
TI  - A New Reactive Force Field for NOx-Water Interactions: Development, Evaluation, and Molecular Dynamics Simulation of Peroxynitrite.
AU  - Shaban M
AU  - van Duin ACT
AU  - van Duin D
AU  - Kowalik M
AU  - Izadi ME
AU  - Weber AP
AU  - Merkert N
PY  - 2026
JO  - The journal of physical chemistry. B
DO  - 10.1021/acs.jpcb.6c03657
UR  - https://doi.org/10.1021/acs.jpcb.6c03657
ER  - 

APA

M, S., ACT, V. D., D, V. D., M, K., ME, I., AP, W., & N, M. (2026). A New Reactive Force Field for NOx-Water Interactions: Development, Evaluation, and Molecular Dynamics Simulation of Peroxynitrite.. The journal of physical chemistry. B. https://doi.org/10.1021/acs.jpcb.6c03657

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