Theoretical insights into non-Arrhenius behaviors of thermal vacancies in anharmonic crystals

Vacancies are prevalent point defects in crystals, but their thermal responses are elusive. Herein, we formulate a simple theoretical model to shed light on the vacancy evolution during heating. Vibrational excitations are thoroughly investigated via moment recurrence techniques in quantum statistic...

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Bibliographic Details
Main Authors: Tran, Dinh Cuong, Anh, D. Phan
Format: Bài trích
Language:English
Published: Royal Society of Chemistry 2022
Subjects:
Online Access:https://pubs.rsc.org/en/content/articlelanding/2022/CP/D2CP00116K
https://dlib.phenikaa-uni.edu.vn/handle/PNK/5751
https://doi.org/10.1039/D2CP00116K
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