About: First-principles study of the formation and migration of native defects inNaAlH4

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scholarly article in Physical Review B, vol. 80 no. 22, December 2009

Attributes	Values
rdf:type	Item
description	artículu científicu (ast) wetenschappelijk artikel (nl) article scientifique publié en 2009 (fr) наукова стаття, опублікована в грудні 2009 (uk) im Dezember 2009 veröffentlichter wissenschaftlicher Artikel (de) scholarly article in Physical Review B, vol. 80 no. 22, December 2009 (en)
publication date	wds:Q56423930-F0941574-FC3D-44D2-857F-78B4ECB9C6CA
publication date	2009-12-04 00:00:00Z (xsd:dateTime)
language of work or name	wds:Q56423930-9328A1BB-3BB4-447D-A253-9F59DF14132B
language of work or name	English
cites work	wds:Q56423930-15DA2081-F80F-47F4-9930-596A0AD3A08D wds:Q56423930-5607B8DE-7182-4F1A-A548-C62FB262DD1B wds:Q56423930-6A792C23-8C39-4F19-948F-51B13857F612 wds:Q56423930-87069F75-6A9F-426B-A4A9-812C7BFC32B9 wds:Q56423930-894C9BC9-B58B-4A71-A971-4CF052DBDFC5 wds:Q56423930-AE4A5F16-A83A-4BF1-BCA8-F6164F14F9BC wds:Q56423930-B2A972F8-77C6-46E4-8669-12FB144C866F wds:Q56423930-CD7E6526-1703-43DA-A512-B78B9F114AE6 wds:Q56423930-D4073F32-3230-47A5-B8D3-1861C5AE2DEE wds:Q56423930-D908F89D-7724-4879-967C-CA183ACCCB5B wds:Q56423930-E194C03B-2E8E-42F5-9049-768C0E6123F2
cites work	Generalized Gradient Approximation Made Simple Projector augmented-wave method Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set First-principles calculations for defects and impurities: Applications to III-nitrides Vacancy-mediated dehydrogenation of sodium alanate Role of charged defects and impurities in kinetics of hydrogen storage materials: A first-principles study Ti-doped alkali metal aluminium hydrides as potential novel reversible hydrogen storage materials A kinetics model of hydrogen absorption and desorption in Ti-doped NaAlH4 Titanium and native defects in LiBH4and NaAlH4 Hydrogen-related defects in sodium alanate
author name string	wds:Q56423930-17A7380F-E8B3-497B-AD51-8D3ED82B34C1 wds:Q56423930-A1330FB4-B9D5-4294-B558-B7C594978F03
author name string	Amra Peles Gareth B. Wilson-Short
rdfs:label	First-principles study of the formation and migration of native defects inNaAlH4 (en) First-principles study of the formation and migration of native defects inNaAlH4 (nl)
skos:prefLabel	First-principles study of the formation and migration of native defects inNaAlH4 (en) First-principles study of the formation and migration of native defects inNaAlH4 (nl)
name	First-principles study of the formation and migration of native defects inNaAlH4 (en) First-principles study of the formation and migration of native defects inNaAlH4 (nl)
author	wds:Q56423930-90D7C0D2-CD6B-4F83-B702-604D1B1603D9 wds:Q56423930-E7230292-BC99-4151-8CB7-D386625E396F wds:Q56423930-EB48D9B0-B733-4177-9CC4-C10467ADFB04
author	Chris G. Van de Walle Anderson Janotti Khang Hoang
title	wds:Q56423930-05D3348F-6604-4146-84E4-B08F097EAC6F
title	First-principles study of the formation and migration of native defects inNaAlH4 (en)
instance of	wds:Q56423930-D83B0CCE-6515-4D12-809E-5EAD8A005CBE
instance of	scholarly article
published in	wds:Q56423930-5A7BDE03-BB93-411C-A3A8-855F4BCF8B02
published in	Physical Review B
issue	wds:Q56423930-F46F0647-9757-45CC-9342-5CCC350052EE
volume	wds:Q56423930-A829D06C-6C9F-476C-BED4-31DBCAC23093
issue	22
volume	80
DOI	wds:Q56423930-28ECF42A-167C-42B7-B650-8F0721AE8C1F
DOI	http://dx.doi.org/10.1103/PHYSREVB.80.224102
DOI	10.1103/PHYSREVB.80.224102
ResearchGate publication ID	wds:Q56423930-BEF314FB-199F-4A45-B6B2-50AA003A1864
ResearchGate publication ID	236965762
arXiv ID	wds:Q56423930-F3E1556D-D108-4FBD-80A1-FF51CBCB31B9
arXiv ID	0911.2813
is about of	https://www.wikidata.org/wiki/Special:EntityData/Q56423930
is cites work of	The particle-size dependence of the activation energy for decomposition of lithium amide Mechanisms for the decomposition and dehydrogenation of Li amide/imide First-principles study of the formation and migration of native defects in LiNH2BH3. Decomposition mechanism and the effects of metal additives on the kinetics of lithium alanate
is cites work of	wds:Q46386180-F0DCFD15-EC4B-4C37-8012-0D6C3E51EA60 wds:Q44208152-44175FC8-5EBA-47A4-9FF1-564792B0D119 wds:Q46450743-2D58CC32-E388-4B1F-BF31-D779C3EA9A7B wds:Q56423348-2EEFD65C-6492-4C1D-B0C7-E199BBB1716C

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