[QE-users] apply constant velocity on the atoms
Lu Hailin
415005271 at qq.com
Wed Feb 20 04:08:06 CET 2019
Dear all,
I have designed a model with two self-mated Fe(110) surfaces. During the dynamic simulations,the bottom layer of the lower slab (the substrate) was held rigid, while the upper slab (the counter-surface) was moved at constant velocity.
How can I apply constant velocity on the atoms through the whole progress using cp.x in Quantum Espresso 6.1. version .
Any help would be appreciated.
Thank you!
Best regards,
------
LU Hailin, Graduate Student
State Key Laboratory of Mechanical Transmission, Chongqing University
Chongqing 400044, China
Tel: (+86) 18362360286
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