Quantum mechanics-molecular dynamics approach to the interpretation of x-ray absorption spectra

Journal of Physics Condensed Matter

Volumn 21, Issue 5, 2009, Pages

  Kuzmin, A ^a   Evarestov, R A ^b  

^a UNIVERSITY OF LATVIA   (Latvia)

^b ST PETERSBURG STATE UNIVERSITY   (Russian Federation)

Author keywords

[No Author keywords available]

Indexed keywords

ELECTROMAGNETIC WAVE ABSORPTION; MOLECULAR DYNAMICS; OXIDE MINERALS; PEROVSKITE; QUANTUM THEORY;

AB-INITIO; CO-ORDINATION SHELLS; CUBIC PEROVSKITES; EMPIRICAL PARAMETERS; EXAFS; MOLECULAR DYNAMICS SIMULATIONS; MULTIPLE-SCATTERING; QUANTUM MECHANICS; STATIC AND DYNAMIC DISORDERS; TEMPERATURE EFFECTS; X-RAY ABSORPTION SPECTRUM;

DYNAMICS;

EID: 63649122942     PISSN: 09538984     EISSN: 1361648X     Source Type: Journal    
DOI: 10.1088/0953-8984/21/5/055401     Document Type: Article

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