| 34 |
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* |
| 35 |
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* [1] Meineke, et al., J. Comp. Chem. 26, 252-271 (2005). |
| 36 |
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* [2] Fennell & Gezelter, J. Chem. Phys. 124, 234104 (2006). |
| 37 |
< |
* [3] Sun, Lin & Gezelter, J. Chem. Phys. 128, 24107 (2008). |
| 38 |
< |
* [4] Vardeman & Gezelter, in progress (2009). |
| 37 |
> |
* [3] Sun, Lin & Gezelter, J. Chem. Phys. 128, 234107 (2008). |
| 38 |
> |
* [4] Kuang & Gezelter, J. Chem. Phys. 133, 164101 (2010). |
| 39 |
> |
* [5] Vardeman, Stocker & Gezelter, J. Chem. Theory Comput. 7, 834 (2011). |
| 40 |
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*/ |
| 41 |
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#ifndef APPLICATIONS_STATICPROPS_NANOLENGTH_HPP |
| 42 |
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#define APPLICATIONS_STATICPROPS_NANOLENGTH_HPP |
| 48 |
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#include "selection/SelectionManager.hpp" |
| 49 |
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#include "applications/staticProps/StaticAnalyser.hpp" |
| 50 |
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|
| 51 |
< |
typedef std::pair<int, RealType> evIndex; |
| 51 |
> |
typedef std::pair<RealType, int> evIndex; |
| 52 |
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|
| 53 |
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namespace OpenMD { |
| 54 |
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class NanoLength : public StaticAnalyser { |