Spin-state bifurcation between hydrogenation and oxygen activation in [Fe(Cp)(CO)₂]: a DFT study toward a spin-aware molecular d-manifold descriptor
- DOI
- 10.1007/s00894-026-06890-6
- Published
- 2026-08-10
- Container
- Journal of Molecular Modeling
- Publisher
- Springer Science and Business Media LLC
- Open access
- unknown
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Cite this work
BibTeX
@article{allodium:10.1007/s00894-026-06890-6,
title = {Spin-state bifurcation between hydrogenation and oxygen activation in [Fe(Cp)(CO)₂]: a DFT study toward a spin-aware molecular d-manifold descriptor},
author = {Frans Augusthinus Asmuruf and Supeno Supeno and Ilham Salim and Yohanis Irenius Mandik and Jonathan Kiwasi Wororomi},
year = {2026},
journal = {Journal of Molecular Modeling},
doi = {10.1007/s00894-026-06890-6},
url = {https://doi.org/10.1007/s00894-026-06890-6}
}RIS
TY - JOUR TI - Spin-state bifurcation between hydrogenation and oxygen activation in [Fe(Cp)(CO)₂]: a DFT study toward a spin-aware molecular d-manifold descriptor AU - Frans Augusthinus Asmuruf AU - Supeno Supeno AU - Ilham Salim AU - Yohanis Irenius Mandik AU - Jonathan Kiwasi Wororomi PY - 2026 JO - Journal of Molecular Modeling DO - 10.1007/s00894-026-06890-6 UR - https://doi.org/10.1007/s00894-026-06890-6 ER -
APA
Asmuruf, F. A., Supeno, S., Salim, I., Mandik, Y. I., & Wororomi, J. K. (2026). Spin-state bifurcation between hydrogenation and oxygen activation in [Fe(Cp)(CO)₂]: a DFT study toward a spin-aware molecular d-manifold descriptor. Journal of Molecular Modeling. https://doi.org/10.1007/s00894-026-06890-6
Source records
- crossref · retrieved 2026-09-25T11:56:21.679Z