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option to calculate only subset of atoms in local representations #26

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merged 4 commits into from
Jul 1, 2017
Merged

option to calculate only subset of atoms in local representations #26

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5f01e58
option to calculate only subset of atoms in local representations
larsbratholm Jun 30, 2017
81a82ec
added reference calculation of representations
larsbratholm Jul 1, 2017
ff1fee9
finalized reference testing
larsbratholm Jul 1, 2017
ca06004
fixed error in test
larsbratholm Jul 1, 2017
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finalized reference testing
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@larsbratholm
larsbratholm committed Jul 1, 2017
commit ff1fee9da14646ea105f68f9aa93ca48896acf27
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