New stable structures of HeN₃ predicted using first-principles calculations

Engineering & Materials Science

• Density functional theory 100%
• Atoms 69%
• Electronic structure 49%
• Crystal structure 43%
• Energy gap 37%
• Helium 37%
• Distribution functions 34%
• Enthalpy 34%
• Molecules 32%
• Nitrogen 30%

Chemical Compounds

• Pressure 77%
• Enthalpy of Formation 64%
• Density Functional Theory 41%
• Distribution Function 41%
• Azide 30%
• P21 27%
• Band Gap 25%
• Electronic State 24%
• Crystal Structure 16%