Ab initio-Monte Carlo studies on the finite-temperature properties of L10 FeAu superlattice

Jian Tao Wang, Lei Zhou, Ding Sheng Wang, Yoshiyuki Kawazoe

Research output: Contribution to journalArticlepeer-review

4 Citations (Scopus)

Abstract

The ab initio-Monte Carlo method was applied on the L10 ordered FeAu superlattice to study its finite temperature magnetic properties. The self-consistent full-potential linearized augmented-plane-wave method was used to calculate the magnetic structures in the superlattice and extract the exchange parameters from the obtained ab initio total energies. Based on a Heisenberg model, the extracted parameters were used to perform the Monte Carlo simulations.

Original languageEnglish
Pages (from-to)601-604
Number of pages4
Journalmaterials transactions, jim
Volume41
Issue number5
DOIs
Publication statusPublished - 2000 May

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