AngleBondsPressureKernel Struct Reference

#include <bond_pressure_kokkos.hpp>

Collaboration diagram for AngleBondsPressureKernel:

Public Member Functions
	AngleBondsPressureKernel (BondsPressureKernelData data_, LocalBondState::AngleBondlistType bond_list_, LocalBondState::AngleBondIDType bond_ids_)
ESPRESSO_ATTR_ALWAYS_INLINE KOKKOS_INLINE_FUNCTION void	operator() (std::size_t idx) const

Public Attributes
BondsPressureKernelData	data
LocalBondState::AngleBondlistType	bond_list
LocalBondState::AngleBondIDType	bond_ids

Detailed Description

Definition at line 105 of file bond_pressure_kokkos.hpp.

Constructor & Destructor Documentation

AngleBondsPressureKernel()

AngleBondsPressureKernel::AngleBondsPressureKernel ( BondsPressureKernelData  data_, LocalBondState::AngleBondlistType  bond_list_, LocalBondState::AngleBondIDType  bond_ids_  )

inline

Definition at line 110 of file bond_pressure_kokkos.hpp.

Member Function Documentation

operator()()

ESPRESSO_ATTR_ALWAYS_INLINE KOKKOS_INLINE_FUNCTION void AngleBondsPressureKernel::operator() ( std::size_t  idx ) const

inline

Definition at line 117 of file bond_pressure_kokkos.hpp.

References BondsPressureKernelData::aosoa, bond_broken_error(), bond_ids, bond_list, BondsPressureKernelData::bonded_ias, BondsPressureKernelData::box_geo, calc_bonded_three_body_pressure_tensor(), data, Utils::flatten(), BondsPressureKernelData::layout, and BondsPressureKernelData::local_pressure.

Member Data Documentation

bond_ids

LocalBondState::AngleBondIDType AngleBondsPressureKernel::bond_ids

Definition at line 108 of file bond_pressure_kokkos.hpp.

Referenced by operator()().

bond_list

LocalBondState::AngleBondlistType AngleBondsPressureKernel::bond_list

Definition at line 107 of file bond_pressure_kokkos.hpp.

Referenced by operator()().

data

BondsPressureKernelData AngleBondsPressureKernel::data

Definition at line 106 of file bond_pressure_kokkos.hpp.

Referenced by operator()().

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The documentation for this struct was generated from the following file:

• bond_pressure_kokkos.hpp