Dear all,<br><br>I'm launching cp2k (mainly Quick-Step) to an IBM machine. It seems the compilation is ok. But when I test it for liquid water with 32 molecules(just using the example attached in the tests/QS/32H2O-md.inp). The machince is:<br>
<br>IBM eServer pSeries 595 with 64 PowerPC_POWER5 1.9 GHz processors and 256 Gb of main memory<br><br>I was using 30 cpus, but then I met problem...see attachment for the standard output. Below is in the "reg.err" file.<br>
<br>.......<br>ATTENTION: 0031-728 Cannot set stack limit to 9223372036854775807, hard limit is 53687091200.<br>ATTENTION: 0031-728 Cannot set stack limit to 9223372036854775807, hard limit is 53687091200.<br>ERROR: 0031-250 task 22: Terminated<br>
ERROR: 0031-250 task 0: Terminated<br>ERROR: 0031-250 task 1: Terminated<br>.......<br><br>Thanks<br>Sincerely, Yunfeng <br>