Partitioning of molecular systems and subsystem replacement by single-centered perturbations: II. Applications of the pseudo substituent technique within hückel molecular orbital theory

Autor:	Kenneth J. Miller, Douglas Franklyn Sherman, Daniel Dilella
Rok vydání:	2009
Předmět:	Physics chemistry.chemical_compound chemistry Substituent Physical and Theoretical Chemistry Molecular systems Hückel method Condensed Matter Physics Molecular physics Atomic and Molecular Physics and Optics Fragment molecular orbital
Zdroj:	International Journal of Quantum Chemistry. 8:187-199
ISSN:	1097-461X 0020-7608
DOI:	10.1002/qua.560080823
Databáze:	OpenAIRE
Externí odkaz:	https://explore.openaire.eu/search/publication?articleId=doi_________::555b5434522f6c6ae1aa3c4973722576 https://doi.org/10.1002/qua.560080823 Zobrazit plný text záznamu Plný text