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G03 Search did not lower the energy significantly. No lower point found -- switch to scaled steepest descent. Search did not lower the energy significantly. Scaled steepest descent with Shift=0.000 failed. Search did not lower the energy significantly. Scaled steepest descent with Shift=0.025 failed. Search did not lower the energy significantly. Scaled steepest descent with Shift=0.050 failed. Search did not lower the energy significantly. Scaled steepest descent with Shift=0.075 failed. Search did not lower the energy significantly. No lower point found -- switch to steepest descent. Search did not lower the energy significantly. No lower point found -- run aborted. Error termination via Lnk1e in C:\G03W\l508.exe at Fri Jun 15 19:09:09 2012. Job cpu time: 0 days 10 hours 13 minutes 29.0 seconds. ÊÇÔõô»ØÊ°¡£¿ File lengths (MBytes): RWF= 11 Int= 0 D2E= 0 Chk= 4 Scr= 1 |
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