Quantum Monte Carlo for electronic excitations of free-base porphyrin

Journal of Chemical Physics

Volumn 120, Issue 7, 2004, Pages 3049-3050

  Aspuru Guzik, Alán ^a   El Akramine, Ouafae ^b   Grossman, Jeffrey C ^c   Lester Jr , William A ^a,b  

^a UNIVERSITY OF CALIFORNIA   (United States)

^b LAWRENCE BERKELEY NATIONAL LABORATORY   (United States)

^c LAWRENCE LIVERMORE NATIONAL LABORATORY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

EXCITED STATE; FREE-BASE PORPHYRIN (FBP);

COMPUTATIONAL METHODS; ELECTRON TRANSITIONS; ERROR ANALYSIS; FLUORESCENCE; GROUND STATE; MOLECULAR STRUCTURE; MONTE CARLO METHODS; QUANTUM THEORY;

PORPHYRINS;

PORPHYRIN;

ARTICLE; CHEMICAL MODEL; CHEMICAL STRUCTURE; CHEMISTRY; COMPUTER SIMULATION; ELECTRONICS; MONTE CARLO METHOD; QUANTUM THEORY;

COMPUTER SIMULATION; ELECTRONICS; MODELS, CHEMICAL; MODELS, MOLECULAR; MONTE CARLO METHOD; PORPHYRINS; QUANTUM THEORY;

EID: 1642402969     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1646356     Document Type: Article

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