Pressure-induced formation of noble metal hydrides

Journal of Physical Chemistry C

Volumn 116, Issue 2, 2012, Pages 1995-2000

  Gao, Guoying ^a   Wang, Hui ^a   Zhu, Li ^a   Ma, Yanming ^a  

^a JILIN UNIVERSITY   (China)

Author keywords

[No Author keywords available]

Indexed keywords

AMBIENT CONDITIONS; CRYSTAL STRUCTURE PREDICTION; FIRST-PRINCIPLES CALCULATION; HIGH PRESSURE; HIGH-PRESSURE STRUCTURES; METAL SUBLATTICES; MONOHYDRIDES; OCTAHEDRAL INTERSTITIAL SITE; PARTICLE SWARM OPTIMIZATION TECHNIQUE; PURE ELEMENTS; STRUCTURAL CHANGE; ZERO TEMPERATURES;

CALCULATIONS; DENSITY FUNCTIONAL THEORY; HYDRIDES; HYDROGEN; IRIDIUM; METALS; OSMIUM; PALLADIUM; PLATINUM; PRECIOUS METALS; RHODIUM; STRUCTURAL METALS;

CRYSTAL STRUCTURE;

EID: 84862911645     PISSN: 19327447     EISSN: 19327455     Source Type: Journal    
DOI: 10.1021/jp210780m     Document Type: Article

References (39)

1. Kenichi, T. Phys. Rev. B 2004, 70, 012101
2. Cynn, H.; Klepeis, J. E.; Yoo, C. S.; Young, D. A. Phys. Rev. Lett. 2002, 88, 135701
3. Holmes, N. C.; Moriarty, J. A.; Gathers, G. R.; Nellis, W. J. J. Appl. Phys. 1989, 66, 2962-2967
4. Cristina, B.; Kevin, R. Supercond. Sci. Technol. 2005, 18, R1
5. McMahon, M. I.; Nelmes, R. J. Chem. Soc. Rev. 2006, 35, 943-963
6. Gregoryanz, E.; Sanloup, C.; Somayazulu, M.; Badro, J.; Fiquet, G.; Mao, H. K.; Hemley, R. J. Nat. Mater. 2004, 3, 294-297
7. Wang, S.; Mao, H. K.; Chen, X. J.; Mao, W. L. Proc. Natl. Acad. Sci. U.S.A.. 2009, 106, 14763-14767
8. Strobel, T. A.; Somayazulu, M.; Hemley, R. J. Phys. Rev. Lett. 2009, 103, 065701
9. Strobel, T. A.; Chen, X. J.; Somayazulu, M.; Hemley, R. J. J. Chem. Phys. 2009, 133, 164512-164519
10. Somayazulu, M. S.; Finger, L. W.; Hemley, R. J.; Mao, H. K. Science 1996, 271, 1400-1402
11. Crowhurst, J. C.; Goncharov, A. F.; Sadigh, B.; Zaug, J. M.; Aberg, D.; Meng, Y.; Prakapenka, V. B. J. Mater. Res. 2008, 23, 1-5
12. Crowhurst, J. C.; Goncharov, A. F.; Sadigh, B.; Evans, C. L.; Morrall, P. G.; Ferreira, J. L.; Nelson, A. J. Science 2006, 311, 1275-1278
13. Young, A. F.; Sanloup, C.; Gregoryanz, E.; Scandolo, S.; Hemley, R. J.; Mao, H. K. Phys. Rev. Lett. 2006, 96, 155501
14. Smithson, H.; Marianetti, C. A.; Morgan, D.; Van der Ven, A.; Predith, A.; Ceder, G. Phys. Rev. B 2002, 66, 144107
15. Degtyareva, O.; Proctor, J. E.; Guillaume, C. L.; Gregoryanz, E.; Hanfland, M. Solid State Commun. 2009, 149, 1583-1586
16. Hirao, N.; Hiroshi, F.; Yasuo, O.; Kenichi, T.; Takumi, K. Acta Crystallogr. 2008, A64, C609
17. Antonov, V. E. J. Alloys. Compd. 2002, 330-332, 110-116
18. Somenkov, V. A.; Glazkov, V. P.; Irodova, A. V.; Shilstein, S. S. J. Less-Common Met. 1987, 129, 171-180
19. Scheler, T.; Degtyareva, O.; Marqués, M.; Guillaume, C. L.; Proctor, J. E.; Evans, S.; Gregoryanz, E. Phys. Rev. B 2011, 83, 214106
20. Wang, Y.; Lv, J.; Zhu, L.; Ma, Y. Phys. Rev. B 2010, 82, 094116
21. Li, P.; Gao, G.; Wang, Y.; Ma, Y. J. Phys. Chem. C 2011, 114, 21745-21749
22. Lv, J.; Wang, Y.; Zhu, L.; Ma, Y. Phys. Rev. Lett. 2011, 106, 015503
23. Zhu, L.; Wang, H.; Wang, Y.; Lv, J.; Ma, Y.; Cui, Q.; Ma, Y.; Zou, G. Phys. Rev. Lett. 2011, 106, 145501
24. Besedin, S. P.; Jephcoat, A. P.; Hanfland, M. High Pressure Res. 2000, 17, 225-234
25. Fukai, Y. Metal-Hydrogen System; Springer: Berlin, 2005.
26. Perdew, J. P.; Burke, K.; Ernzerhof, M. Phys. Rev. Lett. 1996, 77, 3865-3868
27. Kresse, G.; Furthmüler, J. Phys. Rev. B 1996, 54, 11169-11186
28. Blöhl, P. E. Phys. Rev. B 1994, 50, 17953-17979
29. Monkhorst, H. J.; Pack, J. D. Phys. Rev. B 1976, 13, 5188-5192
30. Parlinski, K.; Li, Z. Q.; Kawazoe, Y. Phys. Rev. Lett. 1997, 78, 4063
31. Togo, A.; Oba, F.; Tanaka, I. Phys. Rev. B 2008, 78, 134106
32. Kim, D. Y.; Scheicher, R. H.; Pickard, C. J.; Needs, R. J.; Ahuja, R. Phys. Rev. Lett. 2011, 107, 117002
33. Aberg, D.; Sadigh, B.; Crowhurst, J.; Goncharov, A. F. Phys. Rev. Lett. 2008, 100, 095501
34. Li, Y.; Wang, H.; Li, Q.; Ma, Y.; Cui, T.; Zou, G. Inorg. Chem. 2009, 48, 9904-9909
35. Errea, I.; Rousseau, B.; Bergara, A. Phys. Rev. Lett. 2011, 106, 165501
36. Hammer, B.; Norskov, J. K. Nature 1995, 376, 238-240
37. Ma, Y.; Tse, J. S.; Klug, D. D.; Ahuja, R. Phys. Rev. B 2004, 70, 214107
38. Schirber, J. E.; Northrup, C. J. M. Phys. Rev. B 1974, 10, 3818
39. Stritzker, B.; Buckel, W. Z. Phys. A: Hadrons Nucl. 1972, 257, 1-8