DFT study of the chemistry of sulfur in graphite, including interactions with defects, edges and folds

J-J Adjizian; CD Latham; S Oberg; PR Briddon; MI Heggie

doi:10.1016/j.carbon.2013.05.063

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DFT study of the chemistry of sulfur in graphite, including interactions with defects, edges and folds

Journal article

Peer reviewed

DFT study of the chemistry of sulfur in graphite, including interactions with defects, edges and folds

J-J Adjizian, CD Latham, S Oberg, PR Briddon and MI Heggie

CARBON, Vol.62, pp.256-262

01/10/2013

DOI: https://doi.org/10.1016/j.carbon.2013.05.063

Abstract

Science & Technology

Physical Sciences

Technology

Chemistry

Physical

Materials Science

Multidisciplinary

Chemistry

Materials Science

CHEMISTRY

PHYSICAL

MATERIALS SCIENCE

MULTIDISCIPLINARY

MINIMUM ENERGY PATHS

ELASTIC BAND METHOD

SADDLE-POINTS

GRAPHITIZATION

GRAPHENE

SUPERCONDUCTIVITY

CARBONIZATION

HYDROCARBONS

STABILITY

CARBONS

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Title: DFT study of the chemistry of sulfur in graphite, including interactions with defects, edges and folds
Creators: J-J Adjizian
CD Latham
S Oberg
PR Briddon
MI Heggie
Publication Details: CARBON, Vol.62, pp.256-262
Publisher: PERGAMON-ELSEVIER SCIENCE LTD
Date published: 01/10/2013
Date submitted: 17/05/2017
Identifiers: 99510959502346
Academic Unit: University of Surrey
Language: English
Resource Type: Journal article

DFT study of the chemistry of sulfur in graphite, including interactions with defects, edges and folds

Abstract

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