Ye Luo
Test this please
I dug into the `*bandinfo.dat` which the spline builder outputs. There are 4 states having very close eigenvalues in DFT. band 0-71 are occupied by the builder by default. at...
> Something is strange here. In each case (4.99, 5.00, 5.01), the 4 7 and 8 7 orbitals are lowest in KS energy. Only at 5.00 are they picked. Why...
This issue remains with gcc-12 on my mac. It is an issue of gcc on mac I believe.
> Does macports or brew installed clang have any issues? It would be good to have a recommendable route and to update the build recipe in the manual. I only...
Did you mean in the old days Job exits but files not ready due to slow filesystem? I feel checking job status is a prerequisites to check files.
> The new estimators follow the rule that we accumulate weighted measurements and we average only once before data is committed. Obviously the output of dmc.dat does not take this...
Looks good in 6.3.0