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Journal of Physical Chemistry B

Volumn 113, Issue 50, 2009, Pages 16151-16158

Born-Oppenheimer molecular dynamics of the hydration of Na+ in a water cluster

(2) Galamba, N a Costa Cabral, B J b

a UNIVERSITY OF LISBON (Portugal)

b UNIVERSITY OF LISBON (Portugal)

Author keywords

[No Author keywords available]

Indexed keywords

ELECTRIC NETWORK TOPOLOGY; HYDRATES; MOLECULAR DYNAMICS; MOLECULES; POSITIVE IONS; SHELLS (STRUCTURES); VIBRATIONAL SPECTRA;

BLUE SHIFT; BORN-OPPENHEIMER MOLECULAR DYNAMICS; CLUSTER PROPERTY; COORDINATION SPHERE; FIRST HYDRATION SHELL; H-BOND NETWORK; HYDRATED CATIONS; O-H STRETCHING BANDS; SMALL REDUCTION; SODIUM CATIONS; SPECIFIC ORIENTATION; WATER CLUSTER; WATER MOLECULE;

HYDRATION;

EID: 73449088761 PISSN: 15206106 EISSN: None Source Type: Journal
DOI: 10.1021/jp904901b Document Type: Article

Times cited : (13)

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