OptaDOS - A new tool for EELS calculations

Journal of Physics: Conference Series

Volumn 371, Issue , 2012, Pages

  Nicholls, R J ^a   Morris, A J ^b   Pickard, C J ^b   Yates, J R ^a  

^a UNIVERSITY OF OXFORD   (United Kingdom)

^b UNIVERSITY COLLEGE LONDON   (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

ADAPTIVE OPTICS; ATOMIC PHYSICS; CHEMICAL BONDS; CODES (SYMBOLS); ELECTRON ENERGY LEVELS; ELECTRON MICROSCOPY; ELECTRONS; ENERGY DISSIPATION; MAGNETIC CORES; TRANSMISSION ELECTRON MICROSCOPY;

DIFFERENT STRUCTURE; ELECTRON ENERGY LOSS SPECTRUM; ENERGY RESOLUTIONS; EXPERIMENTAL METHODS; LINEAR EXTRAPOLATION; SEPARATE ANALYSIS; SPECTRAL PROPERTIES; TRANSMISSION ELECTRON;

DENSITY FUNCTIONAL THEORY;

EID: 84865433910     PISSN: 17426588     EISSN: 17426596     Source Type: Conference Proceeding    
DOI: 10.1088/1742-6596/371/1/012062     Document Type: Conference Paper

References (10)

1. Clark SJ, Segall MD, Pickard CJ, Hasnip PJ, Probert MJ, Refson K and Payne MC 2005 Z. Kristall. 220 567-70
2. Rehr JJ, Kas JJ, Prange MP, Sorini AP, Takimoto Y and Vila F 2009 Comptes Rendus Physique 10 548-59
3. Blaha P, Schwarz K, Madsen GKH, Kvasnicka and D Luitz J 2001 WIEN2k, An Augmented Plane Wave + Local Orbitals Program for Calculating Crystal Properties (Karlheinz Schwarz, Techn. Universität Wien, Austria) ISBN 3-9501031-1-2
4. Morris AJ, Nicholls RJ, Pickard CJ and Yates JR in preparation
5. Martin RM 2004 Electronic Structure (Cambridge: Cambridge University Press)
6. Yates JR, Wang X, Vanderbilt D and Souza I, 2007 Phys. Rev. B 75 195121-1-11
7. Pickard CJ and Payne MC 1997 Inst. Phys. Conf. Ser. 153 637-40
8. Pickard CJ 1997 PhD Thesis University of Cambridge
9. Gao S-P, Pickard CP, Perlov A and Milman V 2009 J. Phys.: Condens. Matter 21 104203-1-12
10. Dash LK, Bruneval F, Trinité V, Vast N and Reining L 2007 Comp. Mat. Sci. 38 482-493