Dear Chem, To practice restart, there are several examples in the tests directory. For examples: cp2k/tests/Fist/regtest-2/H2O-32_NPT_res_2.inp cp2k/tests/Fist/regtest-2/H2O-32_NPT_res_3.inp cp2k/tests/Fist/regtest-2/H2O-32_NPT_res_4.inp cp2k/tests/Fist/regtest-2/H2O-32_NPT_res_5.inp cp2k/tests/Fist/regtest-2/H2O-32_SPME_avg2.inp The key issue is to use &EXT_RESTART, For examples &EXT_RESTART EXTERNAL_FILE ar108-1_122000.restart &END ar108-1_122000.restart is the restart file. Best regards. WANG Riping 2012.10.23 <div class="gmail_quote">On 23 October 2012 09:45, Hanyu <<a href="mailto:ouu...@gmail.com" target="_blank">ouu...@gmail.com</a>> wrote: <blockquote class="gmail_quote" style="margin:0pt 0pt 0pt 0.8ex;border-left:1px solid rgb(204,204,204);padding-left:1ex">The simple way is to set the job.restart as the input of cp2k. for example, cp2k -i Li.restart. Best regards! Hanyu <div class="HOEnZb"><div class="h5"> On Tue, Oct 23, 2012 at 7:06 AM, MR.Chem <<a href="mailto:chemc...@gmail.com">chemc...@gmail.com</a>> wrote: > Hey, Everyone > > How to restart a calculation? I wanna continue to calculate it where just > ended. > > Thank you for help!!! > > ps: I am a fresher.......... > > -- > You received this message because you are subscribed to the Google Groups > "cp2k" group. > To view this discussion on the web visit > <a href="https://groups.google.com/d/msg/cp2k/-/lYwF0zINhrIJ" target="_blank">https://groups.google.com/d/msg/cp2k/-/lYwF0zINhrIJ</a>. > To post to this group, send email to <a href="mailto:cp...@googlegroups.com">cp...@googlegroups.com</a>. > To unsubscribe from this group, send email to > <a href="mailto:cp2k%2Bun...@googlegroups.com">cp2k+uns...@googlegroups.com</a>. > For more options, visit this group at > <a href="http://groups.google.com/group/cp2k?hl=en" target="_blank">http://groups.google.com/group/cp2k?hl=en</a>. </div></div>-- -=*=-=*=-=*=-=*=-=*=-=*=-=*=-=*=-=**=-=**=-=**=-=*=-=*=-=*=-=*=-=*=- Hanyu Liu(刘寒雨), State key Laboratory of Superhard Materials, Jilin University, China Email: <a href="mailto:han...@mails.jlu.edu.cn">han...@mails.jlu.edu.cn</a> or <a href="mailto:ouu...@gmail.com">ouu...@gmail.com</a> skype: ouuing <div class="im HOEnZb"> -- You received this message because you are subscribed to the Google Groups "cp2k" group. </div><div class="HOEnZb"><div class="h5">To post to this group, send email to <a href="mailto:cp...@googlegroups.com">cp...@googlegroups.com</a>. To unsubscribe from this group, send email to <a href="mailto:cp2k%2Bun...@googlegroups.com">cp2k+uns...@googlegroups.com</a>. For more options, visit this group at <a href="http://groups.google.com/group/cp2k?hl=en" target="_blank">http://groups.google.com/group/cp2k?hl=en</a>. </div></div></blockquote></div> -- <div>****************************************************************************** WANG Riping Ph.D student, </div> <div>Institute for Study of the Earth's Interior,Okayama University, 827 Yamada, Misasa, Tottori-ken 682-0193, Japan Tel: +81-858-43-3739(Office), +81-858-43-1215(Inst)</div> <div>E-mail: <a href="mailto:wang.ri...@gmail.com" target="_blank">wang.ri...@gmail.com</a> ****************************************************************************** </div>