a problem about "An invalid set of cell vectors was specified. The determinant det(h) is too small"
anyu... at gmail.com
anyu... at gmail.com
Tue Jan 3 09:37:09 UTC 2017
Dear all,
I want to do the cell_opt for the 4X4X2 graphite, but the output file
always showed that" An invalid set of cell vectors was specified. The
determinant det(h) is too small ". Could anyone tell me the reasons for
this? The attachments are my input and output files.Thanks very much for
all your help!
Best
Yun
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