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On several alternatives for Löwdin orthogonalization
Journal
Computational and Theoretical Chemistry
20
Author
Szczepanik Dariusz
Mrozek Janusz
Volume
1008
Pages
15-19
ISSN
2210-271X
eISSN
2210-2728
Keywords in English
symmetric orthogonalization
Löwdin’s atomic orbital
pre-orthogonalization
Gram-Schmidt procedure
maximum overlap criterion
Language
English
Container language
English
Affiliation
Wydział Chemii : Zakład Metod Obliczeniowych ChemiiWydział Chemii : Zakład Chemii Teoretycznej im. K. Gumińskiego
cris.lastimport.wos | 2024-04-09T21:57:53Z | |
dc.affiliation | Wydział Chemii : Zakład Metod Obliczeniowych Chemii | pl |
dc.affiliation | Wydział Chemii : Zakład Chemii Teoretycznej im. K. Gumińskiego | pl |
dc.contributor.author | Szczepanik, Dariusz - 141875 | pl |
dc.contributor.author | Mrozek, Janusz - 130781 | pl |
dc.date.accessioned | 2015-05-11T08:04:00Z | |
dc.date.available | 2015-05-11T08:04:00Z | |
dc.date.issued | 2013 | pl |
dc.description.admin | [AB] Mrozek, Janusz [SAP11005372] 50000141 | pl |
dc.description.physical | 15-19 | pl |
dc.description.volume | 1008 | pl |
dc.identifier.doi | 10.1016/j.comptc.2012.12.013 | pl |
dc.identifier.eissn | 2210-2728 | pl |
dc.identifier.issn | 2210-271X | pl |
dc.identifier.uri | http://ruj.uj.edu.pl/xmlui/handle/item/6829 | |
dc.language | eng | pl |
dc.language.container | eng | pl |
dc.rights.licence | bez licencji | |
dc.subject.en | symmetric orthogonalization | pl |
dc.subject.en | Löwdin’s atomic orbital | pl |
dc.subject.en | pre-orthogonalization | pl |
dc.subject.en | Gram-Schmidt procedure | pl |
dc.subject.en | maximum overlap criterion | pl |
dc.subtype | Article | pl |
dc.title | On several alternatives for Löwdin orthogonalization | pl |
dc.title.journal | Computational and Theoretical Chemistry | pl |
dc.type | JournalArticle | pl |
dspace.entity.type | Publication |