[ase-users] Asking for Help

[Firas Shuaib]

Dear All,
Hope this email finds you well. This Firas SHUAIB. I am a master holder of Condensed matter physics. Recently, I am trying to learn how to use ASE to train a gap model. I have a problem in creating a dateset. I want to run Molecular dynamics for a simple NVT system  Si  at different temperature [1000, 700, 500, 300]. I have a problem in restarting the simulation, I want when the simulation is done at 1000 to restart from the last point and just the change the temperature. I have tried different ways but non of them worked. Please find attached screenshot. could you guide me with this ?

 Thank you in advance,
 Firas

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