Reverse Monte Carlo refinements of local displacive order in perovskites: AgNbO3 case study

Journal of Physics Condensed Matter

Volumn 22, Issue 40, 2010, Pages

  Krayzman, Victor ^a   Levin, Igor ^a  

^a NATIONAL INSTITUTE OF STANDARDS AND TECHNOLOGY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ATOMIC DISPLACEMENT; ATOMIC ENSEMBLE; COORDINATION ENVIRONMENT; CRYSTALLOGRAPHIC POSITION; DATA SETS; DIFFUSE SCATTERING; EXAFS DATA; EXTENDED X-RAY ABSORPTION FINE STRUCTURES; ORDER-DISORDER BEHAVIOR; POLYCRYSTALLINE SAMPLES; POSITIONAL DISORDER; REVERSE MONTE CARLO REFINEMENTS; TOTAL SCATTERING;

DIELECTRIC PROPERTIES; MONTE CARLO METHODS; PEROVSKITE; SCATTERING; SILVER; SOLID SOLUTIONS;

ATOMS;

CALCIUM DERIVATIVE; NIOBIUM; OXIDE; PEROVSKITE; SILVER DERIVATIVE; TITANIUM;

ARTICLE; CHEMICAL MODEL; CHEMICAL STRUCTURE; CHEMISTRY; COMPUTER SIMULATION; MONTE CARLO METHOD;

CALCIUM COMPOUNDS; COMPUTER SIMULATION; MODELS, CHEMICAL; MOLECULAR STRUCTURE; MONTE CARLO METHOD; NIOBIUM; OXIDES; SILVER COMPOUNDS; TITANIUM;

EID: 78149449109     PISSN: 09538984     EISSN: 1361648X     Source Type: Journal    
DOI: 10.1088/0953-8984/22/40/404201     Document Type: Article

References (22)

1. Billinge S J L and Levin I 2007 Science 316 561
2. Egami T and Billinge S J L 2003 Underneath the Bragg Peaks, Structural Analysis of Complex Materials (New York: Pergamon)
3. Dove M T, Tucker M G and Keen D A 2002 Eur. J. Mineral 14 331
4. Bozin E S, Schmidt M, DeConinck A J, Paglia G, Mitchell J F, Chatteriji T, Radaelli P G, Proffen Th and Billinge S J L 2007 Phys. Rev. Lett. 98 137203
5. Farrow C L, Juhas P, Liu J W, Bryndin D, Bozin E S, Bloch J, Proffen T and Billinge S J L 2007 J. Phys.: Condens. Matter 19 335219
6. McGreevy R L 2001 J. Phys.: Condens. Matter 13 R877
7. Tucker M G, Keen D A, Dove M T, Goodwin A L and Hui Q 2007 J. Phys.: Condens. Matter 19 335218
8. Krayzman V, Levin I, Woicik J C, Proffen Th, Vanderah T A and Tucker M G 2009 J. Appl. Crystallogr. 42 867
9. Krayzman V, Levin I and Tucker M G 2008 J. Appl. Crystallogr. 41 705
10. Comes R, Lambert M and Guinner A 1968 Solid State Commun. 6 715
11. Baba-Kishi K Z, Welberry T R and Withers R L 2008 J. Appl. Crystallogr. 41 930
12. Liu Y, Withers R L, Nguyen B and Elliott K 2007 Appl. Phys. Lett. 91 152907
13. Levin I, Krayzman V, Woicik J C, Karapetrova J, Proffen Th, Tucker M G and Reaney I M 2009 Phys. Rev. B 79 104113
14. Fabry J, Zikmund Z, Kania A and Petricek V 2000 Acta Crystallogr. C 56 916
15. Pawelczyk M 1987 Phase Transit. 8 273
16. Sciau P, Kania A, Dkhil B, Suard E and Ratuszna A 2004 J. Phys.: Condens. Matter 16 2795
17. Fortin W, Kugel G E, Grigas J and Kania A 1996 J. Appl. Phys. 79 4273
18. Valant M, Axelsson A K and Alford N 2007 J. Eur. Ceram. Soc. 27 2549
19. Tucker M G, Squires M P, Dove M T and Keen D A 2001 J. Phys.: Condens. Matter 13 403
20. Withers R L 2005 Z. Kristallogr. 220 1027
21. Goodwin A L, Withers R L and Nguyen H-B 2007 J. Phys.: Condens. Matter 19 335216
22. Kassan-Ogly F A and Naish V E 1986 Acta Crystallogr. B 42 314