Quantum mechanical investigation of the electronic structure and spectral properties of 6,8-dimethylisoxanthopterin

International Journal of Quantum Chemistry

Volumn 88, Issue 1, 2002, Pages 28-33

  Seibert, Eleanore ^a   Ross, J B Alexander ^a   Osman, Roman ^a  

^a MOUNT SINAI SCHOOL OF MEDICINE   (United States)

Author keywords

6,8 dimethylisoxanthopterin; 6 methylisoxanthopterin (6 MI); Deoxyribonucleic acid (DNA); M ller Plesset (MP2)

Indexed keywords

DNA; ELECTRON EMISSION; ELECTRON TRANSITIONS; ELECTRONIC STRUCTURE; GROUND STATE; MAGNETIC MOMENTS; MOLECULES; OPTIMIZATION; ORGANIC SOLVENTS; PROBABILITY DENSITY FUNCTION; PROTEINS; SPECTROSCOPIC ANALYSIS;

DENSITY FUNCTIONAL THEORY (DFT); EMISSION SPECTRA;

QUANTUM THEORY;

EID: 0037066180     PISSN: 00207608     EISSN: None     Source Type: Journal    
DOI: 10.1002/qua.10075     Document Type: Article

References (18)