137 citations · 382 across the 8 of their papers we have counts for
Showing 2014Show all
2 papers · 1 filter
cond-mat.mtrl-sci2014★ 14 cited
Structural, elastic, optical properties and quasiparticle band structure of solid cyanuric triazide
S. Appalakondaiah, G. Vaitheeswaran, S. Lebègue
In this letter, we report the structural, elastic, and quasiparticle band structure of cynauric triazide. The structural properties using a dispersion corrected method to treat van…
cond-mat.mtrl-sci2014★ 44 cited
Structural, vibrational, and quasiparticle band structure of 1, 1 - diamino-2, 2 - dinitroethelene from ab-initio calculations
S. Appalakondaiah, G. Vaitheeswaran, S. Lebègue
The effect of pressure on the structural and vibrational properties of the layered molecular crystal 1,1-diamino-2,2-dinitroethelene (FOX-7) are explored by first principles calcul…