cut3d in Abinit Jiabo Le https://conferences.xsede.org/c/message_boards/find_message?p_l_id=&messageId=820011 2014-12-04T16:03:01Z 2014-12-04T16:03:01Z

Hi Marcela,<br /><br />I followed your instruction to write the script, but still failed. Below is my script, can you help me to see anything wrong? <br /><br /><br />module load abinit<br />export PBS_O_WORKDIR=$(readlink -f $PBS_O_WORKDIR)<br />cd $PBS_O_WORKDIR<br />aprun -n 24 cut3d &lt; input.in<br /><br />Thank you <br /><br />Jiabo

Jiabo Le 2014-12-04T16:03:01Z Ellen Sarah Reifler https://conferences.xsede.org/c/message_boards/find_message?p_l_id=&messageId=744360 2014-07-15T17:05:19Z 2014-07-15T17:05:19Z

Hi,<br /><br />I want to use cut3d in Abinit to analyze a non-formatted _DEN output file. Does anyone know how to properly call the cut3d utility program in a batch job for Blacklight?<br /><br />Thanks,<br />Ellen

Ellen Sarah Reifler 2014-07-15T17:05:19Z