[gpumd] xyz for an atom

  • From: Florencia Carusela <flor.caru@xxxxxxxxx>
  • To: gpumd@xxxxxxxxxxxxx
  • Date: Wed, 27 Nov 2019 14:27:01 -0300

Hi Bruce

As I understand with dump position, it is possible to record atoms
position (every t steps).

But is it possible to record only the position versus time for a given
(selected) atom?

Thanks
Florencia

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