From 69279342434f3483ca1b3f52c3c5fc6ab588169f Mon Sep 17 00:00:00 2001 From: Axel Kohlmeyer Date: Mon, 29 Jan 2024 21:12:41 -0500 Subject: [PATCH] make estimated accuracy output more readable --- src/AMOEBA/pair_amoeba.cpp | 8 ++++---- 1 file changed, 4 insertions(+), 4 deletions(-) diff --git a/src/AMOEBA/pair_amoeba.cpp b/src/AMOEBA/pair_amoeba.cpp index caf29b498af..4cb5c39b610 100644 --- a/src/AMOEBA/pair_amoeba.cpp +++ b/src/AMOEBA/pair_amoeba.cpp @@ -1114,10 +1114,10 @@ void PairAmoeba::print_settings() if (use_ewald) { choose(MPOLE_LONG); - mesg += fmt::format(" multipole: cut {} aewald {} bsorder {} FFT {} {} {}; " - "estimated absolute RMS force accuracy = {:.8g}; " - "estimated relative RMS force accuracy = {:.8g}; " - "mscale {} {} {} {}\n", + mesg += fmt::format(" multipole: cut {} aewald {} bsorder {} FFT {} {} {}\n" + " estimated absolute RMS force accuracy = {:.8g}\n" + " estimated relative RMS force accuracy = {:.8g}\n" + " mscale {} {} {} {}\n", sqrt(off2),aewald,bseorder,nefft1,nefft2,nefft3, estimated_mpole_accuracy,estimated_mpole_accuracy/two_charge_force, special_mpole[1],special_mpole[2],special_mpole[3],special_mpole[4]);