Skip to content

Issues: deepmodeling/dpgen

New issue

Have a question about this project? Sign up for a free GitHub account to open an issue and contact its maintainers and the community.

Sign up for GitHub

By clicking “Sign up for GitHub”, you agree to our terms of service and privacy statement. We’ll occasionally send you account related emails.

Already on GitHub? Sign in to your account

37 Open 266 Closed
37 Open 266 Closed
Author
Filter by author
Loading
Label
Filter by label
Loading
Use alt + click/return to exclude labels
or ⇧ + click/return for logical OR
Projects
Filter by project
Loading
Milestones
Filter by milestone
Loading
Assignee
Filter by who’s assigned
Sort
Sort by
Newest Oldest Most commented Least commented Recently updated Least recently updated Best match
Most reactions
👍 👎 😄 🎉 😕 ❤️ 🚀 👀

Issues list

[BUG] something wrong in dpgen init bulk bug Something isn't working
#1681 opened Dec 2, 2024 by Normadp
[BUG] FP Process Restart Creates New Directory Instead of Continuing Unfinished Tasks bug Something isn't working
#1678 opened Nov 23, 2024 by chenggoj
1
[BUG] Issue with DP-GEN workflow for DPA-2 model using PyTorch backend bug Something isn't working
#1654 opened Oct 8, 2024 by chenggoj
5
I am using dpgen to train an ensemble of 4 models with 3,000,000 steps, but the hpc cluster queue only gives me time for 2 days how can I restart the training from the last step 1,000,000
#1645 opened Sep 29, 2024 by marcog2020460
3
[BUG] Unable to calculate relative force deviation. bug Something isn't working
#1639 opened Sep 18, 2024 by xiaohe-njust
1
[BUG] After dpgen is installed, "dpgen-h" indicates an error in the pyamtgen path bug Something isn't working
#1634 opened Sep 9, 2024 by YXT996
1
Fail to generate initial structures.
#1630 opened Sep 2, 2024 by tianshuliu86
1
how does init_surf link the lattice parameters obtained from init_bulk
#1611 opened Aug 3, 2024 by wangsl613
1
DPGEN encountered the following issue while exploring the potential function of the PtNiMoO system. wontfix This will not be worked on
#1605 opened Jul 29, 2024 by wangsl613
2
IndexError: list index out of range duplicate This issue or pull request already exists
#1595 opened Jul 18, 2024 by xwxwshi
1
ZBL CNtable.txt could not be found awaiting response
#1583 opened Jul 10, 2024 by MingjieWen
7
About running dpgen autotest on WSL ubuntu. Error occured
#1549 opened May 14, 2024 by NKJunhongLi
[Feature Request] problem with “maybe the model devi is nan”
#1543 opened May 9, 2024 by flamingoXu
2
About dpgen autotest: a bug exist when using the process of automatically getting configure from MaterialsProject [BUG] bug Something isn't working
#1497 opened Mar 28, 2024 by NKJunhongLi
[BUG] 训练出来的模型，lammps第一次结合正常，第二次结合有问题
#1493 opened Mar 25, 2024 by wangyi01
2
[BUG] UnboundLocalError: cannot access local variable 'stepbindex' where it is not associated with a value bug Something isn't working
#1490 opened Mar 22, 2024 by PenguinW1105
@njzjz
3
[BUG]Function make_abacus_scf_stru() has no magnetic moment determination. bug Something isn't working
#1487 opened Mar 19, 2024 by metaliuyong
@pxlxingliang
1
whether or not that one can skip 'cell_type' setting in dpgen init_bulk
#1479 opened Mar 6, 2024 by Sanwen-Yang
the error that ’ raise RuntimeError( RuntimeError: md traj iter.000002/01.model_devi/task.000.000000 frame 1 with f devi nan does not belong to either accurate, candidiate and failed, it should not happen‘ occur when dpgen run
#1460 opened Jan 24, 2024 by 12jscvb
6
[BUG] DP-GEN deleted the 'remote_work' folder too fast to continue the workflow: AssertionError: Error: can not find /local_directory/***/confs/eos_00/OUT.ABACUS/running_cell-relax.log bug Something isn't working
#1456 opened Jan 16, 2024 by xdzhu
Thermal conductivity：Dpmd+EMD(Green-kubo)
#1437 opened Dec 26, 2023 by Suyoung999999999
[Feature Request] use MultiSystems in post_fp_vasp function enhancement New feature or request
#1246 opened Jun 16, 2023 by erichuangyf
2
[Feature Request] _Accelerate fp calculation part by splitting it into two steps enhancement New feature or request
#1198 opened Apr 28, 2023 by ZHANG-JINYU-1994
1
[BUG] _dpgen autotest run error_<work_path> bug Something isn't working
#1139 opened Feb 12, 2023 by ZHANG-JINYU-1994
5
[Feature Request] _select which step to do in dpgen run, and manually do some processes_ enhancement New feature or request
#1125 opened Jan 27, 2023 by xczics
ProTip! Updated in the last three days: updated:>2024-11-29.