Issues
- 0
vooro_coord descriptor
#307 opened by sinazadeh - 1
HSE bandgap from vasprun.xml
#312 opened by knc6 - 0
- 0
CHGCAR reshape data
#306 opened by knc6 - 0
Primitive cell and conventional cell are inversed
#305 opened by hjpark1995 - 2
Discrepancy in the modulus calculated by elastic tensor and the ones directly obtained from the database
#304 opened by ChangwenXu98 - 0
Fix lightgbm version
#300 opened by knc6 - 0
- 2
BadZipFile: File is not a zip file
#291 opened by LiangzhengChou - 1
The VASP parameters of MBJ band gap calculations?
#287 opened by szl666 - 0
Fix JARVIS-STM app
#283 opened by knc6 - 0
TBMBJ bandgap
#280 opened by knc6 - 0
Error writing single atom poscar
#273 opened by knc6 - 1
- 2
- 0
JARVIS-DFT Latest 3D Dataset issues
#160 opened by knc6 - 1
Cannot parse selective dynamics POSCAR
#242 opened by sthartman - 0
Vasprun forces for single atom
#248 opened by knc6 - 5
Invalid OPTIMADE API responses
#221 opened by ml-evs - 0
Add HSE06 AND pbe0
#235 opened by knc6 - 0
.
#231 opened by pranoy-ray - 0
- 2
Descriptors meaning Jarvis DFT
#227 opened by giotre - 0
- 3
- 1
- 1
Exfoliation energies in webpages
#180 opened by tavazza - 1
Fix AseAtoms bug
#205 opened by knc6 - 1
Apply continuous integration on jupyter-notebooks
#212 opened by knc6 - 5
LICENSE.rst -> LICENSE
#132 opened by wd15 - 1
Installation tests
#133 opened by wd15 - 0
Fix Atoms.from_xyz()
#213 opened by knc6 - 0
Make latest phonopy work with jarvis-tools
#211 opened by knc6 - 0
Effective mass error
#203 opened by knc6 - 1
Kpoints length to kpoints array conversion
#200 opened by knc6 - 0
- 1
OSError: [Errno 24] Too many open files:
#187 opened by knc6 - 1
Process completed with exit code 137
#190 opened by knc6 - 1
STM image angle
#169 opened by knc6 - 1
atoms.composition.reduced_formula
#184 opened by knc6 - 2
Couldn't find the 'mp_jv_id.json'
#181 opened by hasan-sayeed - 0
Spacegroup convetional cell bug
#168 opened by knc6 - 12
cif2cell breaking conda-forge recipe
#163 opened by wd15 - 0
Update vasp_to_xml.py
#156 opened by knc6 - 2
- 3
conda-forge installation
#126 opened by wd15 - 0
Speed up CFID
#135 opened by knc6 - 2
LICENSE file is messed up
#127 opened by wd15 - 1
Ensure that the license file is packaged in the tarball
#128 opened by wd15 - 1
Is pytest an actually dependency for Jarvis?
#129 opened by wd15