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Volumn 97, Issue 20, 2010, Pages

Point-defect-mediated dehydrogenation of AlH3

Author keywords

[No Author keywords available]

Indexed keywords

CHARGE NEUTRALITY; EXPERIMENTAL VALUES; FORMATION ENERGIES; HYBRID DENSITY FUNCTIONAL CALCULATIONS; HYDROGEN VACANCIES; LOW CONCENTRATIONS; MASS TRANSPORT; MICROSCOPIC MECHANISMS; POSITIVELY CHARGED; RATE LIMITING; ROOM TEMPERATURE;

EID: 78649246526     PISSN: 00036951     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3518475     Document Type: Article
Times cited : (10)

References (23)
  • 1
    • 57649243237 scopus 로고    scopus 로고
    • 0306-0012,. 10.1039/b718842k
    • J. Graetz, Chem. Soc. Rev. 0306-0012 38, 73 (2009). 10.1039/b718842k
    • (2009) Chem. Soc. Rev. , vol.38 , pp. 73
    • Graetz, J.1
  • 5
    • 33748955335 scopus 로고    scopus 로고
    • 3
    • DOI 10.1016/j.jallcom.2005.11.086, PII S0925838805018840
    • J. Graetz and J. J. Reilly, J. Alloys Compd. 0925-8388 424, 262 (2006). 10.1016/j.jallcom.2005.11.086 (Pubitemid 44442862)
    • (2006) Journal of Alloys and Compounds , vol.424 , Issue.1-2 , pp. 262-265
    • Graetz, J.1    Reilly, J.J.2
  • 7
    • 42749104067 scopus 로고    scopus 로고
    • 0556-2805,. 10.1103/PhysRevB.69.144109
    • C. Wolverton, A. Ozolins, and M. Asta, Phys. Rev. B 0556-2805 69, 144109 (2004). 10.1103/PhysRevB.69.144109
    • (2004) Phys. Rev. B , vol.69 , pp. 144109
    • Wolverton, C.1    Ozolins, A.2    Asta, M.3
  • 13
    • 0037799714 scopus 로고    scopus 로고
    • 0021-9606, () 10.1063/1.1564060;, J. Chem. Phys. 0021-9606 124, 219906 (2006). 10.1063/1.2204597
    • J. Heyd, G. E. Scuseria, and M. Ernzerhof, J. Chem. Phys. 0021-9606 118, 8207 (2003) 10.1063/1.1564060; J. Heyd, G. E. Scuseria, and M. Ernzerhof, J. Chem. Phys. 0021-9606 124, 219906 (2006). 10.1063/1.2204597
    • (2003) J. Chem. Phys. , vol.118 , pp. 8207
    • Heyd, J.1    Scuseria, G.E.2    Ernzerhof, M.3    Heyd, J.4    Scuseria, G.E.5    Ernzerhof, M.6
  • 14
    • 2442537377 scopus 로고    scopus 로고
    • 0556-2805,. 10.1103/PhysRevB.54.11169
    • G. Kresse and J. Furthmüller, Phys. Rev. B 0556-2805 54, 11169 (1996). 10.1103/PhysRevB.54.11169
    • (1996) Phys. Rev. B , vol.54 , pp. 11169
    • Kresse, G.1    Furthmüller, J.2
  • 16
    • 0034513054 scopus 로고    scopus 로고
    • Climbing image nudged elastic band method for finding saddle points and minimum energy paths
    • DOI 10.1063/1.1329672
    • G. Henkelman, B. Uberuaga, and H. Jonsson, J. Chem. Phys. 0021-9606 113, 9901 (2000). 10.1063/1.1329672 (Pubitemid 32076883)
    • (2000) Journal of Chemical Physics , vol.113 , Issue.22 , pp. 9901-9904
    • Henkelman, G.1    Uberuaga, B.P.2    Jonsson, H.3
  • 17
    • 21544436440 scopus 로고
    • 0020-1669,. 10.1021/ic50071a005
    • J. W. Turley and H. W. Rinn, Inorg. Chem. 0020-1669 8, 18 (1969). 10.1021/ic50071a005
    • (1969) Inorg. Chem. , vol.8 , pp. 18
    • Turley, J.W.1    Rinn, H.W.2
  • 21
    • 0038172513 scopus 로고    scopus 로고
    • Universal alignment of hydrogen levels in semiconductors, insulators and solutions
    • DOI 10.1038/nature01665
    • C. G. Van de Walle and J. Neugebauer, Nature (London) 0028-0836 423, 626 (2003). 10.1038/nature01665 (Pubitemid 36713219)
    • (2003) Nature , vol.423 , Issue.6940 , pp. 626-628
    • Van De Walle, C.G.1    Neugebauer, J.2


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.