From 4240fc4a730e3ccb188915a928248273e25333d1 Mon Sep 17 00:00:00 2001 From: Cezary Czaplewski Date: Thu, 23 Feb 2017 06:31:50 +0100 Subject: [PATCH] numerical gradient delta 10e-4 --- source/unres/energy.f90 | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/source/unres/energy.f90 b/source/unres/energy.f90 index 7960906..2fdb065 100644 --- a/source/unres/energy.f90 +++ b/source/unres/energy.f90 @@ -10268,7 +10268,7 @@ ! call intcartderiv ! call checkintcartgrad call zerograd - aincr=1.0D-5 + aincr=1.0D-4 write(iout,*) 'Calling CHECK_ECARTINT.' nf=0 icall=0 -- 1.7.9.5