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Commit 9263cc1c authored by Kurt A. O'Hearn's avatar Kurt A. O'Hearn
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sPuReMD: fix BGF parser to correctly remap atom coordinates to internal...

sPuReMD: fix BGF parser to correctly remap atom coordinates to internal simulation box boundaries. Fix reax_list to handle case when total interactions is zero instead of terminating program.
parent bcc9dc2d
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