Listar por tema "First-principles calculation"
Mostrando recursos 1-3 de 3
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An Exercise of Combinatorics and an Application to Ditalgebras
JESUS EFREN PEREZ TERRAZAS; CARLOS JACOB RUBIO BARRIOS -
Elastic and electronic properties of strontium vanadate: an AB initio study
AARON ABRAHAM AGUAYO GONZALEZ; GABRIEL MURRIETA HERNANDEZWe have investigated elastic and thermodynamic properties of strontium vanadate (SrVO3), by calculating their elastic constants within the density functional theory scheme. We present calculations of the elastic constants ... -
Elastic properties of 5d transition-metal carbides: An AB initio study
AARON ABRAHAM AGUAYO GONZALEZ; GABRIEL MURRIETA HERNANDEZ