A theoretical study of vibronic coupling in the photoelectron spectra of Al 6 N−
This work emphasizes the appearance of non-adiabatic effects in the photoelectron spectra
of Al6N−. It includes ab initio electronic structure calculations obtained on the first seven low …
of Al6N−. It includes ab initio electronic structure calculations obtained on the first seven low …
Unraveling the Photoelectron Spectrum of 1-Phospha-2,3,4-triazolate Anion, HCPN3–, A Theoretical Approach
K Srikanth, A Kumar, RR Tammineni - The Journal of Physical …, 2022 - ACS Publications
The first five low-lying electronic states of HCPN3 are probed through extensive ab initio
electronic structure and quantum dynamics studies to reproduce the 193 nm photoelectron …
electronic structure and quantum dynamics studies to reproduce the 193 nm photoelectron …