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1617 (13 years ago) by mciznick: Added sample files for argon: 1000, 10000, 75000. |
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1710 (12 years ago) by gezelter: Added an adapter layer between the AtomType and the rest of the code to handle the bolt-on capabilities of new types. Fixed a long-standing bug in how storageLayout was being set to the maximum possible value. Started to add infrastructure for Polarizable and fluc-Q calculations. |
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1685 (13 years ago) by chuckv: Bug squashes. Pre-existing bug where ppot_row and ppot_col were never zeroed. In non-metallic potentials these arrays should be zero. |