Compiling NwChem 6.8.1 on Ubuntu 18.04 with OpenMPI 4.0 failed

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10:15:01 AM PDT - Mon, Mar 25th 2019

Quote:Ftorazyne Mar 22nd 12:43 pm

Quote:Edoapra Mar 22nd 10:01 am

Please do the following

post the output of the command

grep -i syev $NWCHEM_TOP/src/geom/*F

Output

??> grep -i syev src/geom/*F
src/geom/geom_hnd.F:      call dsyev('v', 'u', nzvar, y, nzvar, e, z, ndim**2, info)
src/geom/geom_hnd.F:      if (info .ne. 0) call errquit('geom_binvr: dsyev failed', info,
src/geom/geom_hnd.F:      call dsyev('v', 'u', nzvar, x, nzvar, e, z, ndim**2, info)
src/geom/geom_hnd.F:      if (info .ne. 0) call errquit('geom_binvr: dsyev2 failed', info,

This means that the execution of make 64_to_32 was not successful
Please send me the stderr/stdout/log of

cd $NWCHEM_TOP/src
rm -f 64_to_32 32_to_64
make 64_to_32