Diborides of Multielement Transition Metals: Methods for Calculating Physical and Mechanical Characteristics

From the first principles simulation (using the method of “a priori pseudopotential” and the “quasi-harmonic approximation” method- author’s developments), the basic characteristics of diborides and diborides of multielement transition metals (DMTMs) with an AlB2 type structure were calculated. For...

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Bibliographic Details
Main Authors: Dora Zakarian, Aik Khachatrian, Sergey Firstov
Format: Article
Language:English
Published: MDPI AG 2024-01-01
Series:Powders
Subjects:
Online Access:https://www.mdpi.com/2674-0516/3/1/4