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| Calculate |
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| Parameters |
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| from
First |
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| Principles |
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| Fit Ortiz |
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| Model
to |
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| Experiment |
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| Ekink |
| Lkink /
b |
| Uedge /
mb3 |
| Eedge /Escrew |
| * |
| * |
| lFR |
| * |
| Kc/b |
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| *
not obtained from atomistics |
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| * atomistic value |
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