added new test case for class1 and class2
7c2fee933eca
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Authored by Axel Kohlmeyer <akohlmey@gmail.com> on Oct 8 2013, 18:34.

Description

added new test case for class1 and class2

Committed

Axel Kohlmeyer <akohlmey@gmail.com>

Oct 8 2013, 18:34

Pushed

junge

Oct 6 2016, 16:49

Parents

rLAMMPSe8653aaafdca: add contributed parameters

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Axel Kohlmeyer <akohlmey@gmail.com> committed rLAMMPS7c2fee933eca: added new test case for class1 and class2 (authored by Axel Kohlmeyer <akohlmey@gmail.com>).Oct 8 2013, 18:34

				Path
	A			tools/msi2lmp/test/hap_crystal-class1.car
	A			tools/msi2lmp/test/hap_crystal-class1.mdf
	A			tools/msi2lmp/test/hap_crystal-class2b.car
	A			tools/msi2lmp/test/hap_crystal-class2b.mdf
	P			tools/msi2lmp/test/in.hap_crystal-class1 Copied from tools/msi2lmp/test/in.h2-h2o-class1
	P			tools/msi2lmp/test/in.hap_crystal-class2b Copied from tools/msi2lmp/test/in.ethane-class2b
	A			tools/msi2lmp/test/reference/hap_crystal-class1.data
	A			tools/msi2lmp/test/reference/hap_crystal-class1.data2
	A			tools/msi2lmp/test/reference/hap_crystal-class2b.data
	A			tools/msi2lmp/test/reference/hap_crystal-class2b.data2
	M			tools/msi2lmp/test/runtests.sh