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gL was set to 0 for many atoms, creating wrong results #129

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ahesse93
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@ahesse93 ahesse93 commented Feb 27, 2023

I set it to 1 by default (which is close enough for most applications), and added the proper value of 1-m_e/m_atom to the atoms that did not set this value to something other than the default so far

…ose enough for most applications), and added the proper value of 1-m_e/m_atom to the atoms that did not set this value to something other than the default so far
@nikolasibalic
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@jonathanpritchard Could you please review this short but important PR? From my side it's cleared for merge.

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Apologies this was in as a placeholder to come back and fix - thanks for updating, the proposed solution looks good.

@nikolasibalic nikolasibalic reopened this Feb 27, 2023
@nikolasibalic nikolasibalic merged commit 348be8b into nikolasibalic:master Feb 27, 2023
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Hi @ahesse93

Thank you very much for this PR. New version v.3.2.7 includes now your contributed correction!

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3 participants