Describe the bug
when running nscf with hse, a cereal error occured in Exx_LRI::read_Hexxs:
-------------------------------------------
NONSELF-CONSISTENT :
-------------------------------------------
START CHARGE : file
NON-SELF CONSISTENT CALCULATIONS
terminate called after throwing an instance of 'terminate called after throwing an instance of 'cereal::Exception'
what(): Error while trying to deserialize a smart pointer. Could not find id 1043816758
cereal::Exception'
what(): Error while trying to deserialize a smart pointer. Could not find id 1043816758
Here's the working directory:
exx-nscf-mgo.zip
Expected behavior
No response
To Reproduce
cmd: mpirun -n 2 ~/abacus-develop/build/abacus > log.txt 2>&1
Environment
Ubuntu 22.04, OneAPI 2023.1.0 (with mpi 2021.9.0)
Additional Context
No response
Describe the bug
when running nscf with hse, a cereal error occured in
Exx_LRI::read_Hexxs:Here's the working directory:
exx-nscf-mgo.zip
Expected behavior
No response
To Reproduce
cmd:
mpirun -n 2 ~/abacus-develop/build/abacus > log.txt 2>&1Environment
Ubuntu 22.04, OneAPI 2023.1.0 (with mpi 2021.9.0)
Additional Context
No response