Building dftd4 into VASP 5.4.4

[saintdav]

Hi there,

I have been trying to build dftd4 into VASP 5.4.4 to no avail. I was wondering whether it would be possible to provide instructions for this version of VASP.

For example, the "vdw_read" subroutine within the file vdwforcefield.F is a little bit different to the example you give in GitHub. Do I only need to replace IVDW<=12 with IVDW<=13?

I also commented the vtutor parts within the subdftd4.F file, but I am not sure whether I did it correctly. There are four calls to vtutor%error and I only commented the line where the call is made. Should I comment each if or else section? Should I also comment vtutor within the used modules and the dummy routine?

Thank you so much for your help!

[awvwgk]

This repository is not maintained anymore by its original author and out-dated with respect to the Vasp integration of dftd4. Please check the instructions in main dftd4 repository for build instructions: https://github.com/dftd4/dftd4#building-vasp-with-support-for-d4.

[awvwgk]

Duplicate of #3

[saintdav]

Hi @awvwgk, thank you so much for let me know what is the correct repository. I will give it a go at those instructions! Cheers.