From feb096873e1ef3735a15a26701cd3f14951c037a Mon Sep 17 00:00:00 2001 From: pscrozi Date: Fri, 24 Aug 2012 16:10:04 +0000 Subject: [PATCH] Bug fix for nbuf_peratom. git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@8713 f3b2605a-c512-4ea7-a41b-209d697bcdaa --- src/KSPACE/pppm.cpp | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/src/KSPACE/pppm.cpp b/src/KSPACE/pppm.cpp index 7bbe6ca4e8..87952c009d 100644 --- a/src/KSPACE/pppm.cpp +++ b/src/KSPACE/pppm.cpp @@ -1330,8 +1330,8 @@ void PPPM::set_fft_parameters() nbuf_peratom = 6*nbuf; if (differentiation_flag != 1) { + nbuf_peratom += nbuf; nbuf *= 3; - nbuf_peratom++; } }