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[BUG] dpdata convert OUTCAR Failed: IndexError: list index out of range

bugSomething isn't workingSomething isn't working

Status: Open.

#836 In deepmodeling/dpdata;

· locard00 opened on Jun 19, 2025

Not all frames can be extracted from the VASP OUTCAR file

enhancementNew feature or requestNew feature or request

Status: Open.

#828 In deepmodeling/dpdata;

· xwxwshi opened on May 27, 2025

dpdata, vasp, NWRITE=0,2

vasp

Status: Open.

#822 In deepmodeling/dpdata;

· wanghan-iapcm opened on May 6, 2025

[Feature Request] how can dpdata.MultiSystems deal with systems without label

deepmdDeePMD-kit formatDeePMD-kit format

enhancementNew feature or requestNew feature or request

Status: Open.

#817 In deepmodeling/dpdata;

· QuantumMisaka opened on Apr 25, 2025

VASP result export type map and poscar mismatch

vasp

Status: Open.

#778 In deepmodeling/dpdata;

· Cc-12342234 opened on Jan 13, 2025

[BUG] Unexpected element order from gro to lammps data file

lammps

Status: Open.

#740 In deepmodeling/dpdata;

· shadowater opened on Oct 21, 2024

[BUG] Abnormal Box Definition after Conversion from ABACUS stru File to LAMMPS lmp File

abacus

bugSomething isn't workingSomething isn't working

lammps

Status: Open.

#739 In deepmodeling/dpdata;

· YuanFeiyue20 opened on Oct 20, 2024

[Feature Request] We need another <code>LabeledSystem</code> input and output format, such as extxyz

enhancementNew feature or requestNew feature or request

help wantedExtra attention is neededExtra attention is needed

Status: Open.

#708 In deepmodeling/dpdata;

· QuantumMisaka opened on Aug 31, 2024

[BUG] convesion from cp2k output to deepMD format

awaiting response

cp2k

Status: Open.

#673 In deepmodeling/dpdata;

· link796 opened on Jun 10, 2024

the structure file lammps.lmp can not be transformed to lammps.dump

enhancementNew feature or requestNew feature or request

help wantedExtra attention is neededExtra attention is needed

lammps

Status: Open.

#664 In deepmodeling/dpdata;

· MumuMaster2021 opened on May 30, 2024

[BUG] Wrong cell shape when convert structure between <code>vasp/poscar</code> and <code>lammps/lmp</code>

bugSomething isn't workingSomething isn't working

lammps

Status: Open.

#651 In deepmodeling/dpdata;

· ZLI-afk opened on May 7, 2024

[Feature Request]

enhancementNew feature or requestNew feature or request

vasp

Status: Open.

#642 In deepmodeling/dpdata;

· ZLI-afk opened on Apr 18, 2024