Some basic properties of the correlation matrices | Zendy

Valdemoro C. | Zendy; Tel L. M. | Zendy; Alcoba D. R. | Zendy; PérezRomero E. | Zendy; Casquero F. J. | Zendy

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Some basic properties of the correlation matrices

Author(s) -

Valdemoro C.,

Tel L. M.,

Alcoba D. R.,

PérezRomero E.,

Casquero F. J.

Publication year - 2002

Publication title -

international journal of quantum chemistry

Language(s) - English

Resource type - Journals

SCImago Journal Rank - 0.484

H-Index - 105

eISSN - 1097-461X

pISSN - 0020-7608

DOI - 10.1002/qua.10338

Subject(s) - rdm , basis (linear algebra) , correlation , density matrix , matrix (chemical analysis) , statistical physics , set (abstract data type) , order (exchange) , basis set , chemistry , computational chemistry , quantum , mathematics , physics , quantum mechanics , density functional theory , computer science , geometry , finance , chromatography , economics , programming language , computer network

On the basis of the properties of correlation matrices, it is shown here that the set of all the first‐order transition reduced density matrices of a system provide complete information about that system. Also, the interrelation between the properties of the correlation matrix and the 2‐RDM N ‐representability conditions is studied. © 2002 Wiley Periodicals, Inc. Int J Quantum Chem, 2002

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