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

26 Open 146 Closed
26 Open 146 Closed
Author
Filter by author
Label
Filter by label
Use alt + click/return to exclude labels
or ⇧ + click/return for logical OR
Projects
Filter by project
Milestones
Filter by milestone
Assignee
Filter by who’s assigned
Sort
Sort by
Newest Oldest Most commented Least commented Recently updated Least recently updated
Most reactions
👍 👎 😄 🎉 😕 ❤️ 🚀 👀

Issues list

Add Phonon calculation into DP_GEN AUTO-TEST model new feature
#956 opened Sep 17, 2022 by 13yong
1
[BUG] some problems about dpgen bug Something isn't working
#880 opened Aug 17, 2022 by Cynthia0807-learn
1
add arguments for lammps revise_template documentation Improvements or additions to documentation
#782 opened Jul 6, 2022 by njzjz
add arguments for lammps buffet documentation Improvements or additions to documentation
#781 opened Jul 6, 2022 by njzjz
add arguments and docs for init_surf documentation Improvements or additions to documentation
#778 opened Jul 6, 2022 by njzjz
1
add arguments and docs for init_bulk documentation Improvements or additions to documentation
#777 opened Jul 6, 2022 by njzjz
1
add fp variant pwmat documentation Improvements or additions to documentation
#774 opened Jul 6, 2022 by njzjz
add model_devi Variant calypso documentation Improvements or additions to documentation
#773 opened Jul 6, 2022 by njzjz
1
add model_devi Variant gromacs documentation Improvements or additions to documentation
#771 opened Jul 6, 2022 by njzjz
[Feature Request]Number of kpoints in z direction for slab DFT calculations new feature
#726 opened May 11, 2022 by yaomz16
3
The combination of Two POTCAR meet an error
#716 opened Apr 25, 2022 by Gauyer
5
autotest proprites
#702 opened Apr 16, 2022 by 13yong
8
dpgen autotest encounter an error "assert( len(data['atom_names'])==len(data['atom_numbs']) )" bug Something isn't working
#680 opened Mar 23, 2022 by xwchen2019
5
After installed the dpgen, an error with 'pip install --user .' bug Something isn't working
#676 opened Mar 20, 2022 by Jeremy1189
2
IndexError: too many indices for array: array is 1-dimensional, but 2 were indexed
#638 opened Jan 24, 2022 by deleep225
4
FileExistsError and FileNotFoundError in dpgen init_bulk wontfix This will not be worked on
#636 opened Jan 22, 2022 by PKUfjh
1
[Feature Request] Speed up dpgen jobs by skipping FP long tail jobs new feature
#630 opened Jan 4, 2022 by shazj99
1
[Feature Request] Invaild soft link of ckpt files in 00.train bug Something isn't working
#622 opened Dec 20, 2021 by axin1212
1
[Feature Request] Use HDF5 instead of numpy files new feature
#617 opened Dec 12, 2021 by njzjz
@njzjz
2
RuntimeError: Job 634fdaf9-f361-4482-96bd-a525e834a435 failed for more than 3 times
#522 opened Aug 26, 2021 by anrushan
9
[BUG] Some of autotest initersitial jobs fail to create element.out bug Something isn't working
#500 opened Aug 19, 2021 by tuoping
@kevinwenminion @tuoping
assert(system.formula == self.formula) AssertionError documentation Improvements or additions to documentation enhancement New feature or request
#425 opened Jun 5, 2021 by AmbroseWong
4
A terrible training accuracy for Al
#421 opened May 27, 2021 by ZhonghengFu
5
How to deal with this error [dpgen autotest make ... self.data['atom_types'] = np.argsort(idx)[self.data['atom_types']] IndexError: index 2 is out of bounds for axis 0 with size 2] bug Something isn't working
#364 opened Apr 3, 2021 by baoqinfu
1
How to restart training from NN in last iteration ?
#330 opened Nov 2, 2020 by Xi-yuanWang
8
ProTip! Follow long discussions with comments:>50.