PairBondsPressureKernel Struct Reference

#include <bond_pressure_kokkos.hpp>

Collaboration diagram for PairBondsPressureKernel:

Public Member Functions
	PairBondsPressureKernel (BondsPressureKernelData data_, LocalBondState::PairBondlistType bond_list_, LocalBondState::PairBondIDType bond_ids_, Coulomb::ShortRangeForceKernel::kernel_type const *coulomb_f_kernel_)
ESPRESSO_ATTR_ALWAYS_INLINE KOKKOS_INLINE_FUNCTION void	operator() (std::size_t idx) const

Public Attributes
BondsPressureKernelData	data
LocalBondState::PairBondlistType	bond_list
LocalBondState::PairBondIDType	bond_ids
Coulomb::ShortRangeForceKernel::kernel_type const *const	coulomb_f_kernel

Detailed Description

Definition at line 48 of file bond_pressure_kokkos.hpp.

Constructor & Destructor Documentation

PairBondsPressureKernel()

PairBondsPressureKernel::PairBondsPressureKernel ( BondsPressureKernelData  data_, LocalBondState::PairBondlistType  bond_list_, LocalBondState::PairBondIDType  bond_ids_, Coulomb::ShortRangeForceKernel::kernel_type const *  coulomb_f_kernel_  )

inline

Definition at line 54 of file bond_pressure_kokkos.hpp.

Member Function Documentation

operator()()

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

inline

Definition at line 63 of file bond_pressure_kokkos.hpp.

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

Member Data Documentation

bond_ids

LocalBondState::PairBondIDType PairBondsPressureKernel::bond_ids

Definition at line 51 of file bond_pressure_kokkos.hpp.

Referenced by operator()().

bond_list

LocalBondState::PairBondlistType PairBondsPressureKernel::bond_list

Definition at line 50 of file bond_pressure_kokkos.hpp.

Referenced by operator()().

coulomb_f_kernel

Coulomb::ShortRangeForceKernel::kernel_type const* const PairBondsPressureKernel::coulomb_f_kernel

Definition at line 52 of file bond_pressure_kokkos.hpp.

Referenced by operator()().

data

BondsPressureKernelData PairBondsPressureKernel::data

Definition at line 49 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