Iron impurity in zircon by DFT computations

Article

Abstract: A single Fe impurity impact on the properties of ZrSiO4 low pressure phase (zircon) has been address

Palabras claves:

Crystal structure, DFT + U, electronic and magnetic properties, zircon

Autores:

A. Stashans, Krupskaya Rivera, Stashans A.

Fuentes:

rraae

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