<div dir="ltr">Thank you Thomas !!!</div><br><div class="gmail_quote"><div dir="ltr" class="gmail_attr">On Thu, Nov 12, 2020 at 12:44 PM Thomas Kühne <<a href="mailto:tku...@gmail.com">tku...@gmail.com</a>> wrote:<br></div><blockquote class="gmail_quote" style="margin:0px 0px 0px 0.8ex;border-left:1px solid rgb(204,204,204);padding-left:1ex"><div style="overflow-wrap: break-word;">Dear Sumit, <div><br></div><div>please have a look at: <a href="https://www.cp2k.org/howto:md" target="_blank">https://www.cp2k.org/howto:md</a> and other provided HowTo topics: <a href="https://www.cp2k.org/howto" target="_blank">https://www.cp2k.org/howto</a></div><div>The following exercise page also contains quite a few examples including sample inputs: <a href="https://www.cp2k.org/exercises" target="_blank">https://www.cp2k.org/exercises</a></div><div>Moreover, please check the regtest folder within your cp2k distribution for example files of most implemented features. </div><div><br></div><div>Cheers, </div><div>Thomas</div><div><div><br><blockquote type="cite"><div>Am 12.11.2020 um 07:22 schrieb sumit agrawal <<a href="mailto:sumitag...@gmail.com" target="_blank">sumitag...@gmail.com</a>>:</div><br><div><div dir="ltr">Dear all <div><br></div><div>I want to do BOMD calculation using CP2K. Can anyone suggest me how to start BOMD calculation ? </div><div><br></div><div>I have a desktop of 8GB RAM with an i5 processor. Can I use this desktop for such a type of calculation ? </div></div><div><br></div>
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