To Whom It May Concern,
I would like to try test run in COMB3 example directory.
However, the calculation gives error:
To Whom It May Concern,
I would like to try test run in COMB3 example directory.
However, the calculation gives error:
and rightfully so.
ERROR: Expected integer parameter instead of ‘2.0’ in input script or data file (…/fix_qeq_comb.cpp:51)
Last command: fix 2 all qeq/comb 2.0 3e-3 optimize file fq.out 1################################################################################
I could not find the z = 2 even though I have checked all of potential, datafile, library file.
this has nothing to do with the potential file. please read the error message more carefully. the error is with the fix qeq/comb command, there you provide a parameter 2.0 where the fix command expects an integer number. read the docs and that 2.0 is the “nevery” parameter, which is integer not floating point.
PEBCAC!
axel.