WITHDRAWN: Computational Insights Into Transition Metal Behavior: a Dft Study on Chromium (Cr), Manganese (Mn), Iron (Fe) and Cobalt (Co)
Abstract
In this work, structural computations are carried out utilizing (FP-LAPW+lo) for Cr, Mn, Fe, and Co. The Wu-Cohen functional (WC) approach in computational density functional analysis deals with the lattice constants problem. The structural and geometric optimization characteristics are computed, revealing that all of these materials are metallic in nature. The cobalt Co is the d-block element, stable in ferromagnetic (FM) phase due to its lowest energy, calculated as -5572.261 Rydberg, in WIEN2k scientific code.
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