Theoretical design of bicyclo[2.2.1]heptane derivatives for high-energy density compounds with low impact sensitivity

2016 ◽  
Vol 1095 ◽  
pp. 54-64 ◽  
Author(s):  
Mingran Du ◽  
Xuguang Wang ◽  
Ziru Guo
Keyword(s):  
Energy Density ◽  
High Energy ◽  
Impact Sensitivity ◽  
High Energy Density ◽  
Theoretical Design ◽  
High Energy Density Compounds

scholarly journals Designing and looking for novel cage compounds based on bicyclo-HMX as high energy density compounds

RSC Advances ◽  
2018 ◽  
Vol 8 (1) ◽  
pp. 44-52 ◽  
Author(s):  
Yong Pan ◽  
Weihua Zhu
Keyword(s):  
Thermal Stability ◽  
Energy Density ◽  
Electronic Structures ◽  
High Energy ◽  
Impact Sensitivity ◽  
High Energy Density ◽  
Cage Compounds ◽  
Energetic Properties ◽  
High Energy Density Compounds

We designed four cage compounds by introducing intramolecular linkages into the bicyclo-HMX framework. Their molecular and electronic structures, energetic properties, thermal stability, and impact sensitivity were evaluated using DFT.

Looking for high energy density compounds among polynitraminecubanes

2012 ◽  
Vol 19 (2) ◽  
pp. 571-580 ◽  
Author(s):  
Wei-Jie Chi ◽  
Lu-Lin Li ◽  
Bu-Tong Li ◽  
Hai-Shun Wu
Keyword(s):  
Energy Density ◽  
High Energy ◽  
High Energy Density ◽  
High Energy Density Compounds
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