Comments (6)
from lammps-user-conp2.
Thank you, Shern. It is working now after I deleted the two files. Btw, the cluster I am using is based on linux system.
from lammps-user-conp2.
Hi Xiaobo,
Could you try compiling the pppm_conp_intel files with "-D BUILD_OMP=no"? Also, could you let me know what compiler and version number you are using?
Thanks,
Shern
from lammps-user-conp2.
Hi Xiaobo,
Could you try compiling the pppm_conp_intel files with "-D BUILD_OMP=no"? Also, could you let me know what compiler and version number you are using?
Thanks,
Shern
It is working using your flag! My compiler is GNU 8.3.0
from lammps-user-conp2.
Hi Shern,
Thank you for developing this code! Unfortunately, I have the same problem as Xiaobo, I use Intel compiler and intelmpi, but I cannot fix this problem by adding the "-D BUILD_OMP=no" flag...
All I can do is remove these two files (i.e., pppm_conp_intel.* ) and recompile the lammps again. My lammps version is 8 Apr 2021. However, the program failed when calculating the matrix, then end up with many core.* files.
Could you please give me some suggestions?
Thanks a lot for your help.
Cheers,
Xiaohui
from lammps-user-conp2.
Hi Xiaohui!
Could you open a new issue and tell me more about what system you are building on, and what compilers and compiler options you used?
Thanks!
Shern
from lammps-user-conp2.
Related Issues (20)
- error while testing HOT 2
- Why the electrodes were stretched toward each other? HOT 2
- Script for reverse potential of electrodes HOT 2
- Does ffield is suitable for my system? HOT 2
- Could this CPM be coupled with ReaxFF? Use them together. HOT 2
- How can l calculate the potential of the system in the z-direction? HOT 2
- How can l calculate the potential of the system in the z-direction?
- Error in fix conp command while running the test code HOT 2
- installing the code HOT 1
- Using the compute potential/atom function HOT 1
- Fix did not correctly charge ghost atoms
- Is the Finite field method equilibrium electric field accurate? HOT 3
- LAMMPS_NS::GridComm" has no member "reverse_comm_kspace HOT 4
- How "etypes [Ntypes] [type1] [type2]" Recognize different types of atoms?
- Using CPM in EMD or NEMD HOT 1
- New feature: Update the A matrix at some interval/frequency HOT 4
- Segmentation Error HOT 3
- 报错USER-INTEL package does not support per-atom stress (../pair_lj_cut_coul_long_intel.cpp:78) noe
- Some confusion about "noslab zneutr" enables fix conp to run a "doubled cell" simulation HOT 1
- How to solve the potential distribution after updating the movable electrode using the cg method?
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