HenryCoefficient¶
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class
HenryCoefficient
: public feasst::Analyze¶ Assumes there is only one Trial, TrialAdd, and it is AlwaysReject-ed. Accumulate \(\langle e^{-\beta \Delta U}\rangle\), where \(\Delta U\) is the energy contribution of the attempt to add the particle.
Public Functions
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std::string
header
(const Criteria &criteria, const System &system, const TrialFactory &trials) const¶ Return the header for writing.
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void
initialize
(Criteria *criteria, System *system, TrialFactory *trial_factory)¶ Initialize and precompute before trials.
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void
update
(const Criteria &criteria, const System &system, const TrialFactory &trial_factory)¶ Perform update action.
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std::string
write
(const Criteria &criteria, const System &system, const TrialFactory &trial_factory)¶ Perform write action.
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std::string