Molecular modelling of cellulose dissolution

Journal of Computational and Theoretical Nanoscience

Volumn 10, Issue 11, 2013, Pages 2639-2646

  Bazooyar, Faranak ^a,b   Taherzadeh, Mohammad ^a   Niklasson, Claes ^b   Bolton, Kim ^a  

^a UNIVERSITY OF BORÅS   (Sweden)

^b CHALMERS UNIVERSITY OF TECHNOLOGY   (Sweden)

Author keywords

Biofuel; Cellulose; Lignocellulosic waste; Molecular modelling

Indexed keywords

B3LYP DENSITY FUNCTIONAL; CELLULOSE DISSOLUTIONS; COMPUTATIONAL STUDIES; FIRST PRINCIPLES METHOD; GRAND CANONICAL MONTE CARLO; LIGNOCELLULOSIC WASTES; MOLECULAR DYNAMICS SIMULATIONS; MOLECULAR MECHANISM;

BIOFUELS; DISSOLUTION; MOLECULAR DYNAMICS; MOLECULAR MODELING;

CELLULOSE;

EID: 84886900534     PISSN: 15461955     EISSN: 15461963     Source Type: Journal    
DOI: 10.1166/jctn.2013.3263     Document Type: Article

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