SCOPUS 정보 검색 플랫폼

Volumn 19, Issue 7, 2013, Pages 2825-2833

The average local ionization energy as a tool for identifying reactive sites on defect-containing model graphene systems

(5) Murray, Jane S a Shields, Zenaida Peralta Inga a Lane, Pat a Macaveiu, Laura a Bulat, Felipe A b

a CleVeTheoComp LLC (United States)

b Fable Theory and Computation (United States)

Author keywords

Average local ionization energy; Corannulene; Defect containing graphene model; Hydrogenation; Inverse Stones Thrower Wales defect; Molecular surface; Reactive site

Indexed keywords

CORANNULENE; CORONENE; GRAPHENE; NANOTUBE; UNCLASSIFIED DRUG;

CONFERENCE PAPER; ENERGY; HYDROGENATION; IONIZATION; MOLECULAR SYSTEMATICS; PRIORITY JOURNAL; SURFACE PROPERTY;

CATALYTIC DOMAIN; COMPUTER SIMULATION; ELECTRONS; GRAPHITE; MODELS, MOLECULAR; SURFACE PROPERTIES;

EID: 84879782886 PISSN: 16102940 EISSN: 09485023 Source Type: Journal
DOI: 10.1007/s00894-012-1693-8 Document Type: Conference Paper

Times cited : (36)

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