ListarQFA_Articles por tema "polymorphs"

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Polymorphs of ZnV2O6 Under Pressure: a First Principle Investigation

Beltran, Armando; Gracia, Lourdes; Andres, Juan American Chemical Society (2019-01-11)

This work presents first-principle calculations on the pressure-dependence of the stabilities, structures, and electronic properties of several polymorphs of ZnV2O6 under the pressure range 0-30 GPa. These properties are ...