Harnessing molecular excited states with Lanczos chains

Journal of Physics Condensed Matter

Volumn 22, Issue 7, 2010, Pages

  Baroni, Stefano ^a,b   Gebauer, Ralph ^b,c   Malcioglu, O Bariş ^a   Saad, Yousef ^d   Umari, Paolo ^b   Xian, Jiawei ^a  

^a SISSA   (Italy)

^b SINCROTRONE TRIESTE   (Italy)

^c ABDUS SALAM INTERNATIONAL CENTRE FOR THEORETICAL PHYSICS   (Italy)

^d UNIVERSITY OF MINNESOTA   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

DENSITY FUNCTIONAL THEORY; ELECTROMAGNETIC WAVE ABSORPTION; LIGHT ABSORPTION; MATHEMATICAL OPERATORS; PHOTOEMISSION; QUANTUM THEORY;

CONTINUED FRACTION; DIAGONAL MATRIX ELEMENTS; MANY BODY PERTURBATION THEORY; OFF-DIAGONAL MATRIX ELEMENTS; PHOTOEMISSION SPECTRA; QUANTUM MECHANICAL; RECURSION METHODS; TIME-DEPENDENT DENSITY;

PERTURBATION TECHNIQUES;

ALGORITHM; ARTICLE; CHEMICAL MODEL; CHEMICAL STRUCTURE; COMPUTER SIMULATION; QUANTUM THEORY; THEORETICAL MODEL;

ALGORITHMS; COMPUTER SIMULATION; MODELS, CHEMICAL; MODELS, MOLECULAR; MODELS, THEORETICAL; QUANTUM THEORY;

EID: 77949644755     PISSN: 09538984     EISSN: 1361648X     Source Type: Journal    
DOI: 10.1088/0953-8984/22/7/074204     Document Type: Article

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