From 47b31c7fc0f1d0bf9c8f0a38cb7db2de3a5bb2e0 Mon Sep 17 00:00:00 2001 From: Ben Hourahine Date: Thu, 23 May 2024 11:05:50 +0100 Subject: [PATCH] Fix citation in comment --- src/dftbp/dftb/coulomb.F90 | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/src/dftbp/dftb/coulomb.F90 b/src/dftbp/dftb/coulomb.F90 index f29ec56d4b..aef49ba75c 100644 --- a/src/dftbp/dftb/coulomb.F90 +++ b/src/dftbp/dftb/coulomb.F90 @@ -2376,7 +2376,7 @@ end function derivRTerm !> Calculates the stress tensor derivatives of the Ewald electrostatics - !> Aguard and Madden J Chem Phys 119 7471 (2003) + !> Aguardo and Madden J Chem Phys 119 7471 (2003) doi: 10.1063/1.1605941 subroutine invRStress(env, nAtom, coord, neighList, recPoint, alpha, volume, q, stress) !> Computational environment settings