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[ÇóÖú] WARNING in EDDIAG: sub space matrix is not hermitian

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entering main loop
       N       E                     dE             d eps       ncg     rms          rms(c)
WARNING in EDDIAG: sub space matrix is not hermitian    1     0.894E-01
RMM:   1     0.379248877504E+04    0.37925E+04   -0.16301E+05  8608   0.171E+03
WARNING in EDDIAG: sub space matrix is not hermitian    1    -0.132E-01
RMM:   2    -0.115234094510E+06   -0.11903E+06   -0.92037E+05  8608   0.256E+03
RMM:   3    -0.585713451833E+05    0.56663E+05   -0.56220E+05  8608   0.484E+02
RMM:   4    -0.448332635995E+05    0.13738E+05   -0.41264E+05  8608   0.503E+02
RMM:   5    -0.430862004318E+05    0.17471E+04   -0.39712E+05  8608   0.382E+02
RMM:   6    -0.469100580687E+05   -0.38239E+04   -0.45018E+05  8608   0.228E+02
RMM:   7    -0.550921140547E+05   -0.81821E+04   -0.52295E+05  8608   0.256E+02
RMM:   8    -0.867246433824E+05   -0.31633E+05   -0.85111E+05  8608   0.142E+02
RMM:   9    -0.508850129435E+03    0.86216E+05    0.23736E+04 28569   0.234E+02
WARNING in EDDIAG: sub space matrix is not hermitian    1    -0.260E-01
RMM:  10    -0.501070145802E+03    0.77800E+01    0.16629E+03 32199   0.191E+01
RMM:  11    -0.494110539989E+03    0.69596E+01   -0.24012E+00 33487   0.209E+00
=================================

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uuv2010(½ð±Ò+1): ¶àлÌáʾ 2011-09-28 11:26:30
byin(½ð±Ò+5): 2011-10-16 16:55:28
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1Â¥: Originally posted by byin at 2011-09-27 21:47:21:
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entering main loop
       N       E                     dE             d eps       ncg     rms     ...

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2Â¥2011-09-28 09:03:41
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byin

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2Â¥: Originally posted by haowenping at 2011-09-28 09:03:41:
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Sub-space-Matrix is not hermitian in DAV
3Â¥2011-09-28 10:41:22
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byin(½ð±Ò+5): 2011-10-16 16:55:35
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