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20 December 2024

17 December 2024

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14 October 2024

  • 12:0112:01, 14 October 2024 diff hist +3,600 N Construction:Troubleshooting electronic convergenceCreated page with "There can be many reasons why convergence to the electronic ground state fails. Below you find some strategies to overcome convergence issues in the electronic minimization. == Step-by-step instructions == '''Step 1:''' Simplify the calculation and reduce time-to-solution. Try to create a minimal INCAR file with as few tags as possible. If the calculation converges, then gradually add them back until you find which one was causi..." current

30 August 2024

5 August 2024

16 July 2024

15 July 2024

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