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852 (21 years ago) by mmeineke: fixed the "Sudden Death" bug. The box was not switching between orthorhombic and non-orthorhombic wrapping correctly. we added a fabs() to the check.which should fix it. |
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535 (21 years ago) by : This commit was manufactured by cvs2svn to create tag 'bob-5_14_03'. |
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853 (21 years ago) by mmeineke: did a merge by hand from the new-templateless branch to the main trunk. bug Fixes include: * fixed the switching function from ortho to non-ortho box. !!!!! THis was responsible for all of the sudden deaths we saw. * some formating in the string when we write out the extended system state. * added NPT.cpp to the makefile.in |