Low-energy structures of benzene clusters with a novel accurate potential surface. | J Comput Chem;36(31): 2291-301, 2015 Dec 05. | MEDLINE

Main content 1 Search 2 Footer 3

+A A -A High contrast

Virtual Health Library

United States - Mexico Border

Subject descriptor lookup Advanced Search

Low-energy structures of benzene clusters with a novel accurate potential surface.

Bartolomei, M; Pirani, F; Marques, J M C.

Affiliation

Bartolomei M; Consejo Superior de Investigaciones Científicas (IFF-CSIC), Instituto de Física Fundamental, Serrano 123, Madrid, 28006, Spain.
Pirani F; Dipartimento di Chimica, Biologia e Biotecnologie, Università di Perugia, Italy.
Marques JM; Departamento de Química, Universidade de Coimbra, 3004-535, Coimbra, Portugal.

J Comput Chem ; 36(31): 2291-301, 2015 Dec 05.

Article in En | MEDLINE | ID: mdl-26422699

Subject(s)

Benzene/chemistry; Quantum Theory; Algorithms; Molecular Structure; Surface Properties

Key words

ab initio calculations; benzene clusters; evolutionary algorithms; global optimization; low-energy structures; semiempirical potential model

Search on Google

Full text: 1 Database: MEDLINE Main subject: Quantum Theory / Benzene Language: En Year: 2015 Type: Article

Search on Google

Full text: 1 Database: MEDLINE Main subject: Quantum Theory / Benzene Language: En Year: 2015 Type: Article