QSPR studies on impact sensitivities of high energy density molecules

Bulletin of the Korean Chemical Society

Volumn 32, Issue 12, 2011, Pages 4341-4346

  Kim, Chan Kyung ^a   Cho, Soo Gyeong ^a,b   Li, Jun ^a   Kim, Chang Kon ^a   Lee, Hai Whang ^a  

^a Inha University   (South Korea)

^b Agency for Defence Development   (South Korea)

Author keywords

High energy density molecule (HEDM); Impact sensitivity; MSEP approach; Quantitative structure property relationship

Indexed keywords

B3LYP/6-31G; DESCRIPTORS; ELECTROSTATIC POTENTIALS; FREQUENCY CALCULATIONS; HIGH ENERGY DENSITIES; HIGH ENERGY DENSITY MATERIALS; HIGH ENERGY DENSITY MOLECULE (HEDM); IMPACT SENSITIVITIES; MOLECULAR SURFACES; MSEP APPROACH; QUANTITATIVE STRUCTURE PROPERTY RELATIONSHIPS; TRAINING SETS; VAN DER WAALS; ZWITTER IONIC MOLECULE;

BENZENE; HIGH ENERGY PHYSICS; SCAFFOLDS; VAN DER WAALS FORCES;

MOLECULES;

EID: 84255172529     PISSN: 02532964     EISSN: 12295949     Source Type: Journal    
DOI: 10.5012/bkcs.2011.32.12.4341     Document Type: Article

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