INVESTIGATION OF ORDERED DISPERSIVE EFFECT, CHARGE DENSITY, THERMAL PROPERTIES AND DISAPPEARANCE OF SPIN POLARIZATION IN PEROVSKITE CSBEO3 UNDER THE INFLUENCE OF PRESSURE-A DFT PERSPECTIVE

Investigation of ordered dispersive effect, charge density, thermal properties and disappearance of spin polarization in perovskite CsBeO3 under the influence of pressure-A DFT perspective

Full Potential Linearized Augmented Plane Wave method (FP-LAPW) was employed to investigate the behavior of cubic perovskite CsBeO3 Roller under the influence of pressure.The spin polarized study has been carried out in PBE-GGA approximation under the application of pressure.The variation of pressure is attained by the appropriate reduction of volu

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