.. index:: pair: struct; forcefields::zhu_philpott_parameters::Standard .. _doxid-structforcefields_1_1zhu__philpott__parameters_1_1_standard: struct forcefields::zhu_philpott_parameters::Standard ===================================================== .. toctree:: :hidden: :ref:`Standard ` parameters for :ref:`ZhuPhilpott `. This is the parameterisation published in the original paper by Zhu and Phillpott. The binding energy of one molecule on a (100) surface is 0.50 eV .. ref-code-block:: cpp :class: doxyrest-overview-code-block #include struct Standard { // fields static double const :target:`sigmaO_` = 2.86; static double const :target:`epsilonO_` = 0.0023734176137013181; static double const :target:`sigmaH_` = 2.56; static double const :target:`epsilonH_` = 0.00087578073518673099; static double const :target:`C10_O_` = 1.28; static double const :target:`C10_H_` = 1.2; static double const :target:`alpha_` = 0.8; static double const :target:`sigmaHPt_` = 2.730249677569295; static double const :target:`sigmaOPt_` = 2.7735458150747108; static double const :target:`epsilonHPt_` = 0.016217645873043762; static double const :target:`epsilonOPt_` = 0.03387330127291549; };