Vibrational Properties of Hydrogen-Bonded Systems Using the Multireference Generalization to the “On-the-Fly” Electronic Structure within Quantum Wavepacket ab Initio Molecular Dynamics (QWAIMD)
Year: 2014
Type: article
DOI: 10.1021/ct5002347
Authors: Junjie Li, Xiaohu Li, Srinivasan S. Iyengar
Institutions: Indiana University Bloomington, Indiana University
Language: English
Subfield: Atomic and Molecular Physics, and Optics
Field: Physics and Astronomy
Domain: Physical Sciences
Open Access status: closed
OpenAlex ID: W2319349994