Browsing División de Nanociencias y Materiales by Author "Reynard, Bruno"
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Anharmonic contribution to the stabilization of Mg(OH)2 from first principles
Treviño, Patricia; Garcia Castro, Andrés Camilo; López Moreno, Sinhué; Bautista Hernández, Alejandro; Bobocioiu, Ema; Reynard, Bruno; Caracas, Razvan; Romero Castro, Aldo Humberto (2018)"Geometrical and vibrational characterization of magnesium hydroxide was performed using density functional theory. Four possible crystal symmetries were explored: P[3 with combining macron] (No. 147, point group −3), C2/m ...