Exciting water: Molecular dynamics (MD) simulations and perturbed matrix method (PMM) calculations were used to obtain detailed information about electronic excitation in liquid water. The graphic shows the excitation spectrum of liquid water at 300 K as obtained by the PMM calculations.

Aschi, M., D'Abramo, M., Di Teodoro, C., Di Nola, A., & Amadei, A. (2005). Theoretical characterisation of the electronic excitation in liquid water. CHEMPHYSCHEM, 6(1), 53-58 [10.1002/cphc.200400265].

Theoretical characterisation of the electronic excitation in liquid water

AMADEI, ANDREA
2005

Abstract

Exciting water: Molecular dynamics (MD) simulations and perturbed matrix method (PMM) calculations were used to obtain detailed information about electronic excitation in liquid water. The graphic shows the excitation spectrum of liquid water at 300 K as obtained by the PMM calculations.
Pubblicato
Rilevanza internazionale
Articolo
Sì, ma tipo non specificato
Settore CHIM/02 - Chimica Fisica
English
Electronic excitation; Molecular dynamics; Photoabsorption; Solvent effects; Water chemistry
Aschi, M., D'Abramo, M., Di Teodoro, C., Di Nola, A., & Amadei, A. (2005). Theoretical characterisation of the electronic excitation in liquid water. CHEMPHYSCHEM, 6(1), 53-58 [10.1002/cphc.200400265].
Aschi, M; D'Abramo, M; Di Teodoro, C; Di Nola, A; Amadei, A
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Utilizza questo identificativo per citare o creare un link a questo documento: http://hdl.handle.net/2108/35265
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