From ce9f99e9c150313f4af4c0c905e96fa8997598cb Mon Sep 17 00:00:00 2001 From: Eddy Barraud Date: Thu, 6 Jun 2024 11:19:06 +0200 Subject: [PATCH] store_answersq for ecoul --- lib/gpu/lal_dpd_charged.cu | 3 +-- 1 file changed, 1 insertion(+), 2 deletions(-) diff --git a/lib/gpu/lal_dpd_charged.cu b/lib/gpu/lal_dpd_charged.cu index 750b05a4ea..4f27c90202 100644 --- a/lib/gpu/lal_dpd_charged.cu +++ b/lib/gpu/lal_dpd_charged.cu @@ -335,7 +335,6 @@ __kernel void k_dpd_charged(const __global numtyp4 *restrict x_, } // if ii store_answers_q(f,energy,e_coul,virial,ii,inum,tid,t_per_atom,offset,eflag,vflag, ans,engv); - } __kernel void k_dpd_charged_fast(const __global numtyp4 *restrict x_, @@ -520,7 +519,7 @@ __kernel void k_dpd_charged_fast(const __global numtyp4 *restrict x_, } // for nbor } // if ii - store_answers(f,energy,virial,ii,inum,tid,t_per_atom,offset,eflag,vflag, + store_answersq(f,energy,e_coul,virial,ii,inum,tid,t_per_atom,offset,eflag,vflag, ans,engv); }