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henniggroup / VASPsol

Solvation model for the plane wave DFT code VASP.
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VASPsol Patch File for VASP 6.4.3 #88

Open JoniSpencer opened 4 months ago

JoniSpencer commented 4 months ago

Dear VASPsol developers,

I am working on compiling VASP 6.4.3 with VASPsol functionality added. Could you please provide the patch file for this edition of VASP that addresses the M_sum_s and FERMISHIFT subroutine issues as given in Issue #43? The patch file provided at the end of the issue does not seem to be compatible with VASP 6.4.3.

Thank you for your help.

Best, Joni Spencer

UmmiAyaan commented 3 months ago

Could you please share VASP Sol patch file for VASP 6.4?

shwetaphd commented 1 week ago

Could you please share VASPsol patch file for vasp version 6.4.3?