Hamiltonian for the electronic states of molecules in chemical transformations

Autor:	L. A. Gribov, N. I. Prokof’eva
Rok vydání:	2012
Předmět:	Solid-state physics Chemistry Wave packet Quantum chemistry Electronic states Schrödinger equation Inorganic Chemistry symbols.namesake Quantum mechanics Materials Chemistry symbols Molecule Physical and Theoretical Chemistry Hamiltonian (quantum mechanics) Quantum
Zdroj:	Journal of Structural Chemistry. 53:645-648
ISSN:	1573-8779 0022-4766
DOI:	10.1134/s0022476612040051
Popis:	Based on the migrating wave packet, it is shown what form the Schrodinger equation for electronic states should have in a quantum description of chemical transformations.
Databáze:	OpenAIRE
Externí odkaz:	https://explore.openaire.eu/search/publication?articleId=doi_________::9d2e38bc0f14819869993160208337d3 https://doi.org/10.1134/s0022476612040051 Zobrazit plný text záznamu Plný text ve formátu PDF