Small cleanup, docs
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@ -65,7 +65,7 @@ OPT.
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* :doc:`drude <fix_drude>`
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* :doc:`drude/transform/direct <fix_drude_transform>`
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* :doc:`drude/transform/inverse <fix_drude_transform>`
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* :doc:`dt/reset <fix_dt_reset>`
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* :doc:`dt/reset (k) <fix_dt_reset>`
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* :doc:`edpd/source <fix_dpd_source>`
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* :doc:`efield <fix_efield>`
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* :doc:`ehex <fix_ehex>`
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@ -250,7 +250,7 @@ OPT.
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* :doc:`tune/kspace <fix_tune_kspace>`
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* :doc:`vector <fix_vector>`
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* :doc:`viscosity <fix_viscosity>`
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* :doc:`viscous <fix_viscous>`
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* :doc:`viscous (k) <fix_viscous>`
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* :doc:`viscous/sphere <fix_viscous_sphere>`
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* :doc:`wall/body/polygon <fix_wall_body_polygon>`
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* :doc:`wall/body/polyhedron <fix_wall_body_polyhedron>`
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@ -118,6 +118,8 @@ void FixDtResetKokkos<DeviceType>::end_of_step()
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}
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/* ---------------------------------------------------------------------- */
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template<class DeviceType>
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KOKKOS_INLINE_FUNCTION
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void FixDtResetKokkos<DeviceType>::operator()(TagFixDtResetMass, const int &i, double &k_dt) const {
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@ -127,7 +129,7 @@ void FixDtResetKokkos<DeviceType>::operator()(TagFixDtResetMass, const int &i, d
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double delx, dely, delz, delr;
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double emax = k_emax.d_view(0);
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if (mask[i] & groupbit) {
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massinv = 1.0 / mass[type[i]];
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@ -148,9 +150,10 @@ void FixDtResetKokkos<DeviceType>::operator()(TagFixDtResetMass, const int &i, d
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delr = sqrt(delx * delx + dely * dely + delz * delz);
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if (delr > xmax) k_dt *= xmax / delr;
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}
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}
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/* ---------------------------------------------------------------------- */
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template<class DeviceType>
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KOKKOS_INLINE_FUNCTION
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void FixDtResetKokkos<DeviceType>::operator()(TagFixDtResetRMass, const int &i, double &k_dt) const {
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@ -160,7 +163,7 @@ void FixDtResetKokkos<DeviceType>::operator()(TagFixDtResetRMass, const int &i,
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double delx, dely, delz, delr;
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double emax = k_emax.d_view(0);
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if (mask[i] & groupbit) {
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massinv = 1.0 / rmass[i];
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@ -181,8 +184,7 @@ void FixDtResetKokkos<DeviceType>::operator()(TagFixDtResetRMass, const int &i,
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delr = sqrt(delx * delx + dely * dely + delz * delz);
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if (delr > xmax) k_dt *= xmax / delr;
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}
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}
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}
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namespace LAMMPS_NS {
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template class FixDtResetKokkos<LMPDeviceType>;
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