Quantum chemical studies of the infrared spectra of OCN <sup>−</sup> in water and icy matrices and their astrophysical implications

Rebecca Tomann, Partha P. Bera, Duncan V. Mifsud, Michel Nuevo, Xinchuan Huang, Scott A. Sandford, Martin Head-Gordon

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DOI: 10.1039/d6cp03141b
Published: 2026
Container: Physical Chemistry Chemical Physics
Publisher: Royal Society of Chemistry (RSC)
Open access: unknown

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Cite this work

BibTeX

@article{allodium:10.1039/d6cp03141b,
  title = {Quantum chemical studies of the infrared spectra of OCN
                    <sup>−</sup>
                    in water and icy matrices and their astrophysical implications},
  author = {Rebecca Tomann and Partha P. Bera and Duncan V. Mifsud and Michel Nuevo and Xinchuan Huang and Scott A. Sandford and Martin Head-Gordon},
  year = {2026},
  journal = {Physical Chemistry Chemical Physics},
  doi = {10.1039/d6cp03141b},
  url = {https://doi.org/10.1039/d6cp03141b}
}

RIS

TY  - JOUR
TI  - Quantum chemical studies of the infrared spectra of OCN
                    <sup>−</sup>
                    in water and icy matrices and their astrophysical implications
AU  - Rebecca Tomann
AU  - Partha P. Bera
AU  - Duncan V. Mifsud
AU  - Michel Nuevo
AU  - Xinchuan Huang
AU  - Scott A. Sandford
AU  - Martin Head-Gordon
PY  - 2026
JO  - Physical Chemistry Chemical Physics
DO  - 10.1039/d6cp03141b
UR  - https://doi.org/10.1039/d6cp03141b
ER  -

APA

Tomann, R., Bera, P. P., Mifsud, D. V., Nuevo, M., Huang, X., Sandford, S. A., & Head-Gordon, M. (2026). Quantum chemical studies of the infrared spectra of OCN <sup>−</sup> in water and icy matrices and their astrophysical implications. Physical Chemistry Chemical Physics. https://doi.org/10.1039/d6cp03141b

Source records

crossref · retrieved 2026-11-10T07:36:26.839Z