Photodissociation of diiodomethane in acetonitrile solution and fragment recombination into iso-diiodomethane studied with ab initio molecular dynamics simulations

Journal of Chemical Physics

Volumn 121, Issue 5, 2004, Pages 2208-2214

  Odelius, Michael ^a   Kadi, Malin ^b   Davidsson, Jan ^b   Tarnovsky, Alexander N ^c  

^a STOCKHOLM UNIVERSITY   (Sweden)

^b UPPSALA UNIVERSITY   (Sweden)

^c EPFL   (Switzerland)

Author keywords

[No Author keywords available]

Indexed keywords

ACETONITRILE; CHEMICAL BONDS; COMPUTER SIMULATION; ELECTRIC EXCITATION; ENERGY DISSIPATION; FREQUENCIES; MOLECULAR DYNAMICS; SOLVENTS; STRETCHING; VIBRATION CONTROL;

CAGE EFFECT; DIIODOMETHANE; FRAGMENT RECOMBINATION; VIBRATION EXCITATION;

PHOTODISSOCIATION;

EID: 4043167588     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1768171     Document Type: Article

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