From 9aef4b90e32b0dd828e41983526e458e8f1288a7 Mon Sep 17 00:00:00 2001 From: Luke Shingles Date: Tue, 24 Aug 2021 14:32:47 +0100 Subject: [PATCH] Fix issue #2 --- artisatomic/readhillierdata.py | 1 - 1 file changed, 1 deletion(-) diff --git a/artisatomic/readhillierdata.py b/artisatomic/readhillierdata.py index 7bc46ec..aa3a2c7 100644 --- a/artisatomic/readhillierdata.py +++ b/artisatomic/readhillierdata.py @@ -882,7 +882,6 @@ def get_hummer_phixstable(lambda_angstrom, a, b, c, d, e, f, g, h): for index, c_en in enumerate(energygrid): energydivthreshold = 1 + 20 * (c_en ** 2) - thresholddivenergy = energydivthreshold ** -1 x = math.log10(energydivthreshold) if x < e: