Effect of transition-metal additives on hydrogen desorption kinetics of MgH2

Applied Physics Letters

Volumn 102, Issue 3, 2013, Pages

  Roy, Anindya ^a   Janotti, Anderson ^a   Van De Walle, Chris G ^a  

^a University of California   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

FIRST-PRINCIPLES CALCULATION; FORMATION ENERGIES; HYDROGEN DESORPTION; HYDROGEN-STORAGE MATERIALS; NATIVE DEFECT;

CALCULATIONS; DESORPTION; HYDROGEN; TRANSITION METALS;

HYDROGEN STORAGE;

EID: 84872958068     PISSN: 00036951     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.4788746     Document Type: Article

References (29)

1. L. Schlapbach and A. Züttel, Nature 414, 353 (2001). 10.1038/35104634
2. M. L. Dresselhaus and I. L. Thomas, Nature 414, 332 (2001). 10.1038/35104599
3. R. A. Varin, T. Czujko, E. B. Wasmund, and Z. S. Wronski, J. Alloys Compd. 432, 217 (2007). 10.1016/j.jallcom.2006.05.129
4. B. Bogdanovic and G. Sandrock, Bull. Mater. Res. Soc. 27, 712 (2002). 10.1557/mrs2002.227
5. G. Liang, J. Huot, S. Boily, A. Van Neste, and R. Schulz, J. Alloys Compd. 292, 247 (1999). 10.1016/S0925-8388(99)00442-9
6. N. Bazzanella, R. Checchetto, and A. Miotello, J. Nanomater. 2011, 865969.
7. P. B. Amama, J. T. Grant, J. E. Spowart, P. J. Shamberger, A. A. Voevodin, and T. S. Fisher, J. Mater. Res. 26, 2725 (2011). 10.1557/jmr.2011.230
8. M. G. Veron, H. Troiani, and F. C. Gennari, Carbon 49, 2413 (2011). 10.1016/j.carbon.2011.02.008
9. Z. Wronski, G. Carpenter, T. Czujko, and R. Varin, Int. J. Hydrogen Energy 36, 1159 (2011). 10.1016/j.ijhydene.2010.06.089
10. H. Shao, M. Felderhoff, F. Schüth, and C. Weidenthaler, Nanotechnology 22, 235401 (2011). 10.1088/0957-4484/22/23/235401
11. J. Huot, E. Akiba, and T. Takada, J. Alloys Compd. 231, 815 (1995). 10.1016/0925-8388(95)01764-X
12. F. Castro and F. Gennari, J. Alloys Compd. 375, 292 (2004). 10.1016/j.jallcom.2003.11.147
13. R. L. Corey, T. M. Ivancic, D. T. Shane, E. A. Carl, R. C. Bowman, J. M. Bellosta von Colbe, M. Dornheim, R. Bormann, J. Huot, R. Zidan, A. C. Stowe, and M. S. Conradi, J. Phys. Chem. C 112, 19784 (2008). 10.1021/jp807900r
14. S. Hao and D. S. Sholl, Appl. Phys. Lett. 93, 251901 (2008). 10.1063/1.3046737
15. M. S. Park, A. Janotti, and C. G. Van de Walle, Phys. Rev. B 80, 064102 (2009). 10.1103/PhysRevB.80.064102
16. A. Peles and C. G. Van de Walle, Phys. Rev. B 76, 214101 (2007). 10.1103/PhysRevB.76.214101
17. C. G. Van de Walle, A. Peles, A. Janotti, and G. B. Wilson-Short, Physica B 404, 793 (2009). 10.1016/j.physb.2008.11.171
18. K. J. Michel and V. Ozolins, J. Phys. Chem. C 115, 21454 (2011). 10.1021/jp203673s
19. K. Hoang, A. Janotti, and C. G. Van de Walle, Phys. Chem. Chem. Phys. 14, 2840 (2012). 10.1039/c2cp23253g
20. J. Heyd, G. Scuseria, and M. Ernzerhof, J. Chem. Phys. 118, 8207 (2003). 10.1063/1.1564060
21. J. Heyd, G. Scuseria, and M. Ernzerhof, J. Chem. Phys. 124, 219906 (2006). 10.1063/1.2204597
22. G. Kresse and J. Furthmüller, Phys. Rev. B 54, 11169 (1996). 10.1103/PhysRevB.54.11169
23. G. Kresse and D. Joubert, Phys. Rev. B 59, 1758 (1999). 10.1103/PhysRevB.59.1758
24. J. Isidorsson, I. A. M. E. Giebels, H. Arwin, and R. Griessen, Phys. Rev. B 68, 115112 (2003), and references therein. 10.1103/PhysRevB.68.115112
25. T. Moriwaki, Y. Akahama, H. Kawamura, S. Nakano, and K. Takemura, J. Phys. Soc. Jpn. 75, 074603 (2006). 10.1143/JPSJ.75.074603
26. C. G. Van de Walle and J. Neugebauer, J. Appl. Phys. 95, 3851 (2004). 10.1063/1.1682673
27. C. Freysoldt, J. Neugebauer, and C. G. Van de Walle, Phys. Rev. Lett. 102, 016402 (2009). 10.1103/PhysRevLett.102.016402
28. C. Freysoldt, J. Neugebauer, and C. G. Van de Walle, Phys. Status Solidi B 248, 1067 (2011). 10.1002/pssb.201046289
29. K. Hoang and C. G. Van de Walle, Phys. Rev. B 80, 214109 (2009). 10.1103/PhysRevB.80.214109