Electronic structure data of singlet N4

Dataset

2020
Many-Body Permutationally Invariant Polynomial Neural Network Potential Energy Surface for N₄
Li, J., Varga, Z., Truhlar, D. G. & Guo, H., Aug 11 2020, In: Journal of Chemical Theory and Computation. 16, 8, p. 4822-4832 11 p.
Research output: Contribution to journal › Article › peer-review
45 Scopus citations
2015
An improved potential energy surface and multi-temperature quasiclassical trajectory calculations of N₂ + N₂ dissociation reactions
Bender, J. D., Valentini, P., Nompelis, I., Paukku, Y., Varga, Z., Truhlar, D. G., Schwartzentruber, T. E. & Candler, G. V., Aug 7 2015, In: Journal of Chemical Physics. 143, 5, 054304.
Research output: Contribution to journal › Article › peer-review
193 Scopus citations
2013
Global ab initio ground-state potential energy surface of N₄
Paukku, Y., Yang, K. R., Varga, Z. & Truhlar, D. G., Jul 28 2013, In: Journal of Chemical Physics. 139, 4, 044309.
Research output: Contribution to journal › Article › peer-review
182 Scopus citations

Research output