Polymerization of nitrogen in cesium azide under modest pressure
Volume: 141, Issue: 4
Published: Jul 28, 2014
Abstract
Alkali metal azides can be used as starting materials in the synthesis of polymeric nitrogen, a potential high-energy-density material. The structural evolutionary behaviors of nitrogen in CsN3 have been studied up to 200 GPa using particle swarm optimization structure search combining with density functional theory. Three stable new phases with C2/m, P21/m, and P-1 structure at pressure of 6, 13, and 51 GPa are identified for the first time....
Paper Details
Title
Polymerization of nitrogen in cesium azide under modest pressure
Published Date
Jul 28, 2014
Volume
141
Issue
4
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