From adeb4277a79745ef9340127e173e1ceb40e973ab Mon Sep 17 00:00:00 2001 From: mkirsz <s1351949@sms.ed.ac.uk> Date: Sat, 21 Dec 2024 17:01:30 +0000 Subject: [PATCH] one less computation --- src/m_tadah_base.cpp | 4 ++-- 1 file changed, 2 insertions(+), 2 deletions(-) diff --git a/src/m_tadah_base.cpp b/src/m_tadah_base.cpp index 2efa8f1..bdba357 100644 --- a/src/m_tadah_base.cpp +++ b/src/m_tadah_base.cpp @@ -153,8 +153,8 @@ stress_force_predict(const StDescriptors &std, Structure &st_) const force_type fij = fpredict(fdij,aedi); const force_type fji = fpredict(fdji,aedj); - v += fpredict(fdij,aedi); - v -= fpredict(fdji,aedj); + v += fij; + v -= fji; for (size_t x=0; x<3; ++x) { for (size_t y=x; y<3; ++y) { -- GitLab