From 54148df6301bf4e1ac7c659fa2aea0e4f9fb68a2 Mon Sep 17 00:00:00 2001 From: Thomas White Date: Wed, 22 Jul 2015 17:23:50 +0200 Subject: Make convergence criterion more stringent --- src/post-refinement.c | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/src/post-refinement.c b/src/post-refinement.c index a35bc655..a10ee781 100644 --- a/src/post-refinement.c +++ b/src/post-refinement.c @@ -864,7 +864,7 @@ static double do_pr_refine(Crystal *cr, const RefList *full, update_partialities(cr, pmodel); dev = residual(cr, full, 0, 0, NULL); - if ( fabs(dev - old_dev) < dev*0.01 ) done = 1; + if ( fabs(dev - old_dev) < dev*0.0001 ) done = 1; if ( verbose ) { STATUS("PR iter %2i: dev = %10.5e, free dev = %10.5e\n", -- cgit v1.2.3