Theoretical study of thiazole adsorption on the (6,0) zigzag single-walled boron nitride nanotube

Bulletin of the Korean Chemical Society

Volumn 33, Issue 10, 2012, Pages 3285-3292

  Moradi, Ali Varasteh ^a   Peyghan, Ali Ahmadi ^b   Hashemian, Saeede ^c   Baei, Mohammad T ^d  

^a ISLAMIC AZAD UNIVERSITY   (Iran)

^b ISLAMIC AZAD UNIVERSITY   (Iran)

^c ISLAMIC AZAD UNIVERSITY   (Iran)

^d ISLAMIC AZAD UNIVERSITY   (Iran)

Author keywords

Adsorption; Binding energy; Boron nitride nanotubes; Drug delivery; Quantum molecular descriptors

Indexed keywords

BORON NITRIDE NANOTUBES; DENSITY FUNCTIONAL THEORY CALCULATIONS; DRUG DELIVERY SYSTEM; ELECTRON DONORS; ELECTROPHILICITY; ENERGY GAP VALUES; EXOTHERMIC PROCESS; FINITE LENGTH; FRONTIER MOLECULAR ORBITALS; FUNCTIONALIZED; GASPHASE; HIGH SENSITIVITY; MOLECULAR DESCRIPTORS; POLAR SOLVENTS; SINGLE-WALLED BORON NITRIDE NANOTUBES; SOLVENT PHASE; THEORETICAL STUDY; VIRTUAL APPLICATION;

ADSORPTION; BINDING ENERGY; DENSITY FUNCTIONAL THEORY; DRUG DELIVERY; ELECTRONIC PROPERTIES; ENERGY GAP; IONIZATION POTENTIAL; MOLECULAR ORBITALS; SOLIDS; SOLVENTS;

NANOTUBES;

EID: 84867877782     PISSN: 02532964     EISSN: 12295949     Source Type: Journal    
DOI: 10.5012/bkcs.2012.33.10.3285     Document Type: Article

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