bug at output of DOSCAR
Posted: Fri Jul 31, 2015 3:20 am
I can run VASP at clusters smoothly and the result viewed by p4vasp is correct. However, the outputs of some files are wrong. For example, the bellows is a section of DOSCAR
……..
-14.272 0.0000E+00 0.0000E+00 0.0000E+00 0.0000E+00
-14.158 0.0000E+00 0.0000E+00 0.0000E+00 0.0000E+00
-14.045 -0.6457-151 0.0000E+00 -0.7341-152 0.0000E+00
……..
Obviously, the format of “-0.6457-151” and “-0.7341-152 ” is wrong. I think this may be due to the setup of complication. Could anyone share your insight on fixing this bug? Thanks a lot.
……..
-14.272 0.0000E+00 0.0000E+00 0.0000E+00 0.0000E+00
-14.158 0.0000E+00 0.0000E+00 0.0000E+00 0.0000E+00
-14.045 -0.6457-151 0.0000E+00 -0.7341-152 0.0000E+00
……..
Obviously, the format of “-0.6457-151” and “-0.7341-152 ” is wrong. I think this may be due to the setup of complication. Could anyone share your insight on fixing this bug? Thanks a lot.