From e4583787646e576e42fec7542e653f26e9ce8513 Mon Sep 17 00:00:00 2001
From: Chris Maffeo <cmaffeo2@illinois.edu>
Date: Fri, 21 Feb 2020 14:24:09 -0600
Subject: [PATCH] Made minimum automatic dimensions 1000
---
bin/mrdna | 2 +-
1 file changed, 1 insertion(+), 1 deletion(-)
diff --git a/bin/mrdna b/bin/mrdna
index bf47058..0c7d04e 100755
--- a/bin/mrdna
+++ b/bin/mrdna
@@ -113,7 +113,7 @@ def main():
model = read_model( str(infile), debye_length=args.debye_length, temperature=args.temperature )
if args.dimensions is None:
- dim = model.dimensions_from_structure( padding_factor=2.5 )
+ dim = [max(x,1000) for x in model.dimensions_from_structure( padding_factor=2.5 )]
model.dimensions = dim
model.origin = model.get_center()-0.5*np.array(model.dimensions)
else:
--
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