Hello, <br><br> I just get in touch molpro recently, and run the first test job and got the following error informations. could anyone give me some clues why it happen?<br><br>output: <br><br>compute-1-13 cluster:0 nodes:1 master=0
<br><br> MPP nodes nproc<br> compute-1-13 1<br> ga_uses_ma=false, calling ma_init with nominal heap.<br> GA-space will be limited to 0.0 words (determined by -G option)<br><br><br>input:<br><br>***,ttest-dir<br>memory,200,m
<br>file,2,test-dir.wfu<br>gdirect<br>geomtyp=zmat<br>geometry={<br>nosym<br>noorient<br>C,, 2.238561188 , 0.214162850 , 0.000248695<br>C,, 2.621931610 , -2.417606353 , 0.000169557<br>C,, 5.090351116
, -3.406557352 , 0.000014148<br>C,, 7.180784670 , -1.762342152 , -0.000087737<br>C,, 6.801123362 , 0.869724514 , 0.000000792<br>C,, 4.331009873 , 1.855368311 , 0.000168119<br>H,, 0.315612189
, 0.977023393 , 0.000379367<br>H,, 0.989118826 , -3.691403811 , 0.000239110<br>H,, 5.386222898 , -5.456806588 , -0.000045841<br>H,, 9.103953627 , -2.531499547 , -0.000227870<br>H,, 8.429007554
, 2.150575487 , -0.000070553<br>H,, 4.034307623 , 3.905621231 , 0.000228146<br>}<br>basis=sto-3g<br>hf;<br>optg<br>---<br><br><br>many thanks in advance!<br><br>bo Li<br>