Dear Sir or Madam,
I finished a MD simulaiton of 1 ps and saved the CONTCAR and the WAVECAR. Based on the saved files, could I retart the vasp to continue this MD simulation for the second ps?
Thanks!
How to continue the MD simulation?
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How to continue the MD simulation?
Last edited by MDrizzle on Thu Mar 19, 2009 5:04 am, edited 1 time in total.
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How to continue the MD simulation?
please follow the instructions of the manual
Last edited by admin on Mon Mar 23, 2009 12:54 pm, edited 1 time in total.