A tool for the interactive 3D visualization of electronic structure in molecules and solids

Computers and Chemistry

Volumn 26, Issue 4, 2002, Pages 313-319

  Terriberry, Timothy B ^a   Cox, David F ^a,b   Bowman, Doug A ^a  

^a VIRGINIA POLYTECHNIC INSTITUTE AND STATE UNIVERSITY   (United States)

^b Virginia Polytechnic Institute and State University   (United States)

Author keywords

3D visualization; Direct manipulation user interface; Electronic structure; VASP

Indexed keywords

ARTICLE;

CHEMICAL BONDS; COMPUTER SIMULATION; ELECTRONIC PROPERTIES; INTERACTIVE COMPUTER GRAPHICS; ITERATIVE METHODS; MOLECULES; PROBABILITY DENSITY FUNCTION; QUANTUM THEORY; SOLIDS; THREE DIMENSIONAL COMPUTER GRAPHICS; USER INTERFACES;

ELECTRON LOCALIZATION FUNCTION (ELF);

ELECTRONIC STRUCTURE;

EID: 0036015854     PISSN: 00978485     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0097-8485(01)00120-6     Document Type: Article

References (18)