Evidence for the existence of oxygen clustering and understanding of structural disorder in prussian blue analogues molecular magnet M 1.5[Cr(CN)6]· Z H2O (M = Fe and Co): Reverse monte carlo simulation and neutron diffraction study

Journal of Physical Chemistry C

Volumn 117, Issue 6, 2013, Pages 2676-2687

  Bhatt, Pramod ^a   Thakur, Nidhi ^a,b   Mukadam, Mayuresh D ^a   Meena, Sher Singh ^a   Yusuf, Seikh M ^a  

^a BHABHA ATOMIC RESEARCH CENTRE   (India)

^b KYOTO UNIVERSITY   (Japan)

Author keywords

[No Author keywords available]

Indexed keywords

CHARACTERISTIC ABSORPTION; DC MAGNETIZATION; DIFFUSE SCATTERING; FACE-CENTERED CUBIC CRYSTALS; FE AND CO; LARGE AMOUNTS; MAGNETIZATION DATA; MOLECULAR MAGNET; MOSSBAUER; NEUTRON DIFFRACTION DATA; NEUTRON DIFFRACTION STUDIES; OXYGEN ATOM; POWDER NEUTRON DIFFRACTION DATA; PRUSSIAN BLUE ANALOGUES; REVERSE MONTE CARLO SIMULATION; SINGLE PHASE; SOFT FERROMAGNETIC; SPACE GROUPS; SSBAUER SPECTROSCOPIES; STRETCHING FREQUENCY; STRUCTURAL AND MAGNETIC PROPERTIES; STRUCTURAL DISORDERS; WATER MOLECULE; X-RAY AND NEUTRON DIFFRACTION;

CYANIDES; INFRARED SPECTROSCOPY; MAGNETIC PROPERTIES; MAGNETIZATION; MOLECULAR OXYGEN; MONTE CARLO METHODS; NEUTRON DIFFRACTION; NICKEL; RIETVELD REFINEMENT; X RAY DIFFRACTION;

COBALT COMPOUNDS;

EID: 84873951334     PISSN: 19327447     EISSN: 19327455     Source Type: Journal    
DOI: 10.1021/jp312395y     Document Type: Article

References (59)

1. Popov, A. Disordered Semiconductors: Physics and Applications; Pan Stanford Publishing Pte. Ltd.: Singapore, 2011.
2. Xiao, G.; Cieplak, M. Z.; Gavrin, A.; Streitz, F. H.; Bakhshai, A.; Chien, C. L. Phys. Rev. Lett. 1988, 60, 1446-1449
3. Sheng, Z. Z.; Hermann, A. M. Nature 1988, 332, 138-139
4. Kudryavtsev, Y. V.; Oksenenko, V. A.; Lee, N. N.; Lee, Y. P.; Rhee, J. Y.; Dubowik, J. J. Appl. Phys. 2005, 97, 113903
5. Lee, Y. P.; Kim, K. W.; Rhee, J. Y.; Kudryavtsev, Y. V. Phys. Rev. B 1999, 59, 546-553
6. Singh, J. Appl. Phys. Lett. 1991, 59, 3142
7. Schultz, A. J.; Wang, H. H.; Williams, J. M.; Filhol, A. J. Am. Chem. Soc. 1986, 108, 7853
8. Petkov, V.; Billinge, S. J. L. Paper presented at the Conference: "From Semiconductors to Proteins: Beyond the Average Structure" held in Traverse City, Michigan, Aug 2001.
9. Petkov, V.; Jeong, I.-K.; Chung, J. S.; Thorpe, M. F.; Kycia, S.; Billinge, S. J. L. Phys. Rev. Lett. 1999, 83, 4089
10. Jeong, I.-K.; Mohiuddin-Jacobs, F.; Petkov, V.; Billinge, S. J. L.; Kycia, S. Phys. Rev. B 2001, 63, 205202
11. Petkov, V.; Billinge, S. J. L.; Larson, P.; Mahanti, S. D.; Vogt, T.; Rangan, K. K.; Kanatzidis, M. G. Phys. Rev. B 2002, 65, 092105
12. Petkov, V.; Billinge, S. J. L.; Shastri, S. D.; Himmel, B. Phys. Rev. Lett. 2000, 85, 3436
13. Seiler, P.; Dunitz, D. Acta Crystallogr. 1979, B35, 1068
14. Cao, D.; Bridges, F.; Anderson, M.; Ramirez, A. P.; Olapinski, M.; Subramanian, M. A.; Booth, C. H.; Kwei, G. H. Phys. Rev. B 2001, 64, 184409
15. Mukadam, M. D.; Yusuf, S. M.; Sasikala, R.; Kulshreshtha, S. K. J. Appl. Phys. 2006, 99, 034310
16. Mukadam, M. D.; Yusuf, S. M.; Sasikala, R. J. Appl. Phys. 2007, 102, 103902
17. Dorset, D. L.; McCourt, M. P. Acta Crystallogr. 1994, A50, 344
18. Tokoroa, H.; Ohkoshi, S.-i. Dalton Trans. 2011, 40, 6825
19. Ohkoshi, S. I.; Abe, Y.; Fujishima, A.; Hashimoto, K. Phys. Rev. Lett. 1999, 82, 1285
20. Kumar, A.; Yusuf, S. M.; Keller, L.; Yakhmi, J. V. Phys. Rev. Lett. 2008, 101, 207206
21. Sato, O.; Iyoda, T.; Fujishima, A.; Hashimoto, K. Science 1996, 272, 704
22. Goodwin, A. L.; Chapman, K. W.; Kepert, C. J. J. Am. Chem. Soc. 2005, 127, 17980
23. Ferlay, S.; Mallah, T.; Ouahes, R.; Veillet, P.; Verdaguer, M. Nature 1995, 378, 701
24. Natesakhawat, S.; Culp, J. T.; Matranga, C.; Bockrath, B. J. Phys. Chem. C 2007, 111, 1055
25. Reguera, L.; Balmaseda, J.; Castillo, L. F. d.; Reguera, E. J. Phys. Chem. C 2008, 112, 5589
26. Thakur, N.; Yusuf, S. M.; Paulose, P. L.; Keller, L. J. Appl. Phys. 2012, 111, 063908
27. Thakur, N.; Yusuf, S. M.; Yakhmi, J. V. Phys. Chem. Chem. Phys. 2010, 12, 12208
28. Bleuzen, A.; Lomenech, C.; Escax, V.; Villain, F.; Varret, F.; Moulin, C. C. d.; Verdaguer, M. J. Am. Chem. Soc. 2000, 122, 6648
29. Goujon, A.; Varret, F.; Escax, V.; Bleuzen, A.; Verdaguer, M. Polyhedron 2001, 20, 1339
30. Tokoro, H.; Ohkoshi, S. Progress in Nano-Electro-Optics VII Chemical, Biological, and Nanophotonic Technologies for Nano-Optical Devices and Systems, 1 st ed.; Springer: Berlin Heidelberg, 2010; Vol. 155.
31. Moritomo, Y.; Hanawa, M.; Ohishi, Y.; Kato, K.; Takata, M.; Kuriki, A.; Nishibori, E.; Sakata, M.; Ohkoshi, S.; Tokoro, H.; Hashimoto, K. Phys. Rev. B 2003, 68, 144106
32. Ohkoshi, S.; Tokoro, H.; Hashimoto, K. Coord. Chem. Rev. 2005, 249, 1830
33. Rietveld, H. M. J. Appl. Crystallogr. 1969, 2, 65
34. Petkov, V.; Billinge, S. J. L.; Heising, J.; Kanatzidis, M. G. J. Am. Chem. Soc. 2000, 122, 11571
35. Egami, T.; Billinge, S. J. L. Underneath the Bragg peaks: structural analysis of complex materials; Pergamon Press Elsevier: Oxford, England, 2003.
36. McGreevy, R. L.; Pusztai, L. Mol. Simul. 1988, 1, 359-367
37. Rodriguez-Carvajal, J. FULLPROF, Nov 2007, website: http://www.ill.eu/ sites/fullprof/.
38. Keen, D. A.; Tucker, M. G.; Dove, M. T. J. Phys.: Condens. Matter 2005, 17, S15-S22
39. Metropolis, N.; Rosenbluth, A. W.; Rosenbluth, M. N.; Teller, A. H.; Teller, E. J. Phys. Chem. 1953, 21, 1087
40. McGreevy, R. L. J. Phys.: Condens. Matter 2001, 13, R877
41. McGreevy, R. L.; Howe, M. A. Annu. Rev. Mater. Sci. 1992, 22, 217
42. McGreevy, R. L.; Howe, M. A. Annu. Rev. Mater. Sci. 1992, 22, 217
43. MellergaÌŠrd, A.; McGreevy, R. L. Acta Crystallogr., Sect. A 1999, 55, 783
44. MellergaÌŠrd, A. RMCPOW, version 2.4; 2005-06-03; website: http://www.isis.rl.ac.uk/RMC/rmcpow.htm.
45. Nakamoto, K. Infrared and Raman Spectra of Inorganic and Coordination Compounds. Part B: Applications in Coordination, Organometallic and Bioinorganic Chemistry, 5 th ed.; Wiley-Interscience: New York, 1997.
46. Reguera, E.; Bertrán, J. F.; Nuńez, L. Polyhedron 1994, 13, 1619
47. Kosaka, W.; Nomura, K.; Hashimoto, K.; Ohkoshi, S. J. Am. Chem. Soc. 2005, 127, 8590
48. Arai, M.; Miyake, M.; Yamada, M. J. Phys. Chem. C 2008, 112, 1953
49. Kumar, A.; Yusuf, S. M.; Keller, L.; Yakhmi, J. V.; Srivastava, J. K.; Paulose, P. L. Phys. Rev. B 2007, 75, 224419
50. Brown, D. B.; Shriver, D. F.; Schwartz, L. H. Inorg. Chem. 1968, 7, 77
51. Buschmann, W. E.; Ensling, J.; Gütlich, P.; Miller, J. S. Chem.-Eur. J 1999, 5, 3019
52. Shriver, D. F.; Shriver, S. A.; Anderson, S. E. Inorg. Chem. 1965, 4, 725
53. Nuida, T.; Matsuda, T.; Tokoro, H.; Sakurai, S.; Hashimoto, K.; Ohkoshi, S.-i. J. Am. Chem. Soc. 2005, 127, 11604
54. Coronado, E.; Giménez-López, M. C.; Korzeniak, T.; Levchenko, G.; Romero, F. M.; Segura, A.; García-Baonza, V. n.; Cezar, J. C.; Groot, F. M. F. d.; Milner, A.; Paz-Pasternak, M. J. Am. Chem. Soc. 2008, 130, 15519
55. Ohkoshi, S.-i.; Hashimoto, K. Chem. Phys. Lett. 1999, 314, 210
56. Greenwood, N. N.; Gibb, T. C. Mössbauer Spectroscopy; Chapman and Hall Ltd.: London, 1971.
57. Kumar, A.; Yusuf, S. M.; Keller, L. Phys. Rev. B 2005, 71, 054414
58. Yusuf, S. M.; Rao, L. M. J. Phys.: Condens. Matter 1995, 7 (29) 5891-5899
59. Yusuf, S. M.; Sahni, V. C.; Rao, L. M. J. Phys.: Condens. Matter 1995, 7, 873