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00:21:11

Structure generation for Quantum ESPRESSO and optimization of bilayer graphene

Аватар
Sweet CentOS
Просмотры:
34
Дата загрузки:
11.10.2024 08:58
Длительность:
00:21:11
Категория:
Обучение

Описание

In this tutorial I have shown how to create the structure for ESPRESSO input starting from a .CIF structure file, using PW Tools. Thereafter I have shown how to carry out a structure optimization with Quantum ESPRESSO with the example of a bilayer graphene.


Speaker: Dr. Amretashis Sengupta
Website: https://sites.google.com/site/ascnel2015/

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