Theoretical study for high-energy-density compounds derived from cyclophosphazene. IV. DFT studies on 1,1-diamino-3,3,5,5,7,7- hexaazidocyclotetraphosphazene and its isomers

Chemistry

• Density Functional Theory 100%
• DFT-B3LYP Calculation 50%
• Energetics 50%
• Enthalpy of Atomization 50%
• Enthalpy of Formation 100%
• Frontier Orbital 50%
• Gaussian Distribution 50%
• Molecular Structure 50%
• Vibrational Frequency 50%