Hydrogen adsorption of Li functionalized Covalent Organic Framework-366: An ab initio study

International Journal of Hydrogen Energy

Volumn 38, Issue 33, 2013, Pages 14276-14280

  Srepusharawoot, Pornjuk ^a,b,d   Swatsitang, Ekaphan ^a,b   Amornkitbamrung, Vittaya ^a,b,d   Pinsook, Udomsilp ^c,d   Ahuja, Rajeev ^e,f  

^a Khon Kaen University   (Thailand)

^b KHON KAEN UNIVERSITY   (Thailand)

^c CHULALONGKORN UNIVERSITY   (Thailand)

^d Thailand Ministry of Science and Technology   (Thailand)

^e UPPSALA UNIVERSITY   (Sweden)

^f ROYAL INSTITUTE OF TECHNOLOGY   (Sweden)

Author keywords

Covalent Organic Framework 366; Hydrogen capacity; Hydrogen storage

Indexed keywords

AB INITIO MOLECULAR DYNAMICS SIMULATION; AB INITIO STUDY; AMBIENT PRESSURES; COVALENT ORGANIC FRAMEWORK-366; DENSITY FUNCTIONAL THEORY METHODS; HYDROGEN ADSORPTION; HYDROGEN CAPACITIES; TOTAL ENERGY CALCULATION;

CALCULATIONS; HYDROGEN; HYDROGEN STORAGE; MOLECULAR DYNAMICS;

LITHIUM;

EID: 84886091980     PISSN: 03603199     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.ijhydene.2013.08.102     Document Type: Article

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