Author Topic: Error in reading the DOSCAR file from VASP in quantumatk  (Read 2435 times)

0 Members and 1 Guest are viewing this topic.

Offline Sudip21

  • New QuantumATK user
  • *
  • Posts: 2
  • Country: us
  • Reputation: 0
    • View Profile
I am getting following error while reading the  DOSCAR filefrom vasp in quantumatk. How to solve this ?


Traceback (most recent call last):
File "zipdir\NL\GUI\MainWindow\LabFloor\LabFloorModel.py", line 333, in load

File "C:\Users\quantum\bamboo-agent-home\xml-data\build-dir\QL-Q1903-W64\python\src\AddOns\VASPPlugins\VASPLabFloorPlugin.py", line 353, in load

File "C:\Users\quantum\bamboo-agent-home\xml-data\build-dir\QL-Q1903-W64\python\src\AddOns\VASPPlugins\Analysis.py", line 476, in createVASPDensityOfStates

File "C:\Users\quantum\bamboo-agent-home\xml-data\build-dir\QL-Q1903-W64\python\src\AddOns\VASPPlugins\IO.py", line 1403, in readDOSCAR

NL.ComputerScienceUtilities.Exceptions.NLValueError: incorrect number of fields in site-projected DOSCAR from file C:\Users\Owner\Desktop\GeSn\vasp_SiGe_2\DOSCAR