oho I got it. Thank you very much .
On Thu, Sep 30, 2021 at 1:14 AM Paolo Giannozzi
wrote:
> On Wed, Sep 29, 2021 at 7:30 PM Peshal Karki wrote:
>
>> My real problem is whether I specified the Wyckoff position correctly or
>> not in my input file
>>
>
> the Wyckoff positions are correctly spec
Dear QE Users and Developers,
Kindly, I am new to cp.x, and in the course of ionic propagation at some
given temperature, I noticed that the fictitious kinetic energy increases at
some finite ionic steps. This may cause ions feel erroneous forces and
therefore erroneous trajectories. So I thi
