514 lines
19 KiB
C++
514 lines
19 KiB
C++
// clang-format off
|
|
/* ----------------------------------------------------------------------
|
|
LAMMPS - Large-scale Atomic/Molecular Massively Parallel Simulator
|
|
https://www.lammps.org/, Sandia National Laboratories
|
|
LAMMPS development team: developers@lammps.org
|
|
|
|
Copyright (2003) Sandia Corporation. Under the terms of Contract
|
|
DE-AC04-94AL85000 with Sandia Corporation, the U.S. Government retains
|
|
certain rights in this software. This software is distributed under
|
|
the GNU General Public License.
|
|
|
|
See the README file in the top-level LAMMPS directory.
|
|
------------------------------------------------------------------------- */
|
|
|
|
#include "atom_vec_atomic_kokkos.h"
|
|
|
|
#include "atom_kokkos.h"
|
|
#include "atom_masks.h"
|
|
#include "comm_kokkos.h"
|
|
#include "domain.h"
|
|
#include "error.h"
|
|
#include "fix.h"
|
|
#include "memory_kokkos.h"
|
|
#include "modify.h"
|
|
|
|
using namespace LAMMPS_NS;
|
|
|
|
/* ---------------------------------------------------------------------- */
|
|
|
|
AtomVecAtomicKokkos::AtomVecAtomicKokkos(LAMMPS *lmp) : AtomVec(lmp),
|
|
AtomVecKokkos(lmp), AtomVecAtomic(lmp)
|
|
{
|
|
|
|
}
|
|
|
|
/* ----------------------------------------------------------------------
|
|
grow atom arrays
|
|
n = 0 grows arrays by DELTA
|
|
n > 0 allocates arrays to size n
|
|
------------------------------------------------------------------------- */
|
|
|
|
void AtomVecAtomicKokkos::grow(int n)
|
|
{
|
|
auto DELTA = LMP_KOKKOS_AV_DELTA;
|
|
int step = MAX(DELTA,nmax*0.01);
|
|
if (n == 0) nmax += step;
|
|
else nmax = n;
|
|
atomKK->nmax = nmax;
|
|
if (nmax < 0 || nmax > MAXSMALLINT)
|
|
error->one(FLERR,"Per-processor system is too big");
|
|
|
|
atomKK->sync(Device,ALL_MASK);
|
|
atomKK->modified(Device,ALL_MASK);
|
|
|
|
memoryKK->grow_kokkos(atomKK->k_tag,atomKK->tag,nmax,"atom:tag");
|
|
memoryKK->grow_kokkos(atomKK->k_type,atomKK->type,nmax,"atom:type");
|
|
memoryKK->grow_kokkos(atomKK->k_mask,atomKK->mask,nmax,"atom:mask");
|
|
memoryKK->grow_kokkos(atomKK->k_image,atomKK->image,nmax,"atom:image");
|
|
|
|
memoryKK->grow_kokkos(atomKK->k_x,atomKK->x,nmax,"atom:x");
|
|
memoryKK->grow_kokkos(atomKK->k_v,atomKK->v,nmax,"atom:v");
|
|
memoryKK->grow_kokkos(atomKK->k_f,atomKK->f,nmax,"atom:f");
|
|
|
|
grow_pointers();
|
|
atomKK->sync(Host,ALL_MASK);
|
|
|
|
if (atom->nextra_grow)
|
|
for (int iextra = 0; iextra < atom->nextra_grow; iextra++)
|
|
modify->fix[atom->extra_grow[iextra]]->grow_arrays(nmax);
|
|
}
|
|
|
|
/* ----------------------------------------------------------------------
|
|
reset local array ptrs
|
|
------------------------------------------------------------------------- */
|
|
|
|
void AtomVecAtomicKokkos::grow_pointers()
|
|
{
|
|
tag = atomKK->tag;
|
|
d_tag = atomKK->k_tag.d_view;
|
|
h_tag = atomKK->k_tag.h_view;
|
|
|
|
type = atomKK->type;
|
|
d_type = atomKK->k_type.d_view;
|
|
h_type = atomKK->k_type.h_view;
|
|
mask = atomKK->mask;
|
|
d_mask = atomKK->k_mask.d_view;
|
|
h_mask = atomKK->k_mask.h_view;
|
|
image = atomKK->image;
|
|
d_image = atomKK->k_image.d_view;
|
|
h_image = atomKK->k_image.h_view;
|
|
|
|
x = atomKK->x;
|
|
d_x = atomKK->k_x.d_view;
|
|
h_x = atomKK->k_x.h_view;
|
|
v = atomKK->v;
|
|
d_v = atomKK->k_v.d_view;
|
|
h_v = atomKK->k_v.h_view;
|
|
f = atomKK->f;
|
|
d_f = atomKK->k_f.d_view;
|
|
h_f = atomKK->k_f.h_view;
|
|
}
|
|
|
|
/* ---------------------------------------------------------------------- */
|
|
|
|
template<class DeviceType,int PBC_FLAG>
|
|
struct AtomVecAtomicKokkos_PackBorder {
|
|
typedef DeviceType device_type;
|
|
|
|
typename ArrayTypes<DeviceType>::t_xfloat_2d _buf;
|
|
const typename ArrayTypes<DeviceType>::t_int_2d_const _list;
|
|
const int _iswap;
|
|
const typename ArrayTypes<DeviceType>::t_x_array_randomread _x;
|
|
const typename ArrayTypes<DeviceType>::t_tagint_1d _tag;
|
|
const typename ArrayTypes<DeviceType>::t_int_1d _type;
|
|
const typename ArrayTypes<DeviceType>::t_int_1d _mask;
|
|
X_FLOAT _dx,_dy,_dz;
|
|
|
|
AtomVecAtomicKokkos_PackBorder(
|
|
const typename ArrayTypes<DeviceType>::t_xfloat_2d &buf,
|
|
const typename ArrayTypes<DeviceType>::t_int_2d_const &list,
|
|
const int & iswap,
|
|
const typename ArrayTypes<DeviceType>::t_x_array &x,
|
|
const typename ArrayTypes<DeviceType>::t_tagint_1d &tag,
|
|
const typename ArrayTypes<DeviceType>::t_int_1d &type,
|
|
const typename ArrayTypes<DeviceType>::t_int_1d &mask,
|
|
const X_FLOAT &dx, const X_FLOAT &dy, const X_FLOAT &dz):
|
|
_buf(buf),_list(list),_iswap(iswap),
|
|
_x(x),_tag(tag),_type(type),_mask(mask),
|
|
_dx(dx),_dy(dy),_dz(dz) {}
|
|
|
|
KOKKOS_INLINE_FUNCTION
|
|
void operator() (const int& i) const {
|
|
const int j = _list(_iswap,i);
|
|
if (PBC_FLAG == 0) {
|
|
_buf(i,0) = _x(j,0);
|
|
_buf(i,1) = _x(j,1);
|
|
_buf(i,2) = _x(j,2);
|
|
_buf(i,3) = d_ubuf(_tag(j)).d;
|
|
_buf(i,4) = d_ubuf(_type(j)).d;
|
|
_buf(i,5) = d_ubuf(_mask(j)).d;
|
|
} else {
|
|
_buf(i,0) = _x(j,0) + _dx;
|
|
_buf(i,1) = _x(j,1) + _dy;
|
|
_buf(i,2) = _x(j,2) + _dz;
|
|
_buf(i,3) = d_ubuf(_tag(j)).d;
|
|
_buf(i,4) = d_ubuf(_type(j)).d;
|
|
_buf(i,5) = d_ubuf(_mask(j)).d;
|
|
}
|
|
}
|
|
};
|
|
|
|
/* ---------------------------------------------------------------------- */
|
|
|
|
int AtomVecAtomicKokkos::pack_border_kokkos(int n, DAT::tdual_int_2d k_sendlist, DAT::tdual_xfloat_2d buf,int iswap,
|
|
int pbc_flag, int *pbc, ExecutionSpace space)
|
|
{
|
|
X_FLOAT dx,dy,dz;
|
|
|
|
if (pbc_flag != 0) {
|
|
if (domain->triclinic == 0) {
|
|
dx = pbc[0]*domain->xprd;
|
|
dy = pbc[1]*domain->yprd;
|
|
dz = pbc[2]*domain->zprd;
|
|
} else {
|
|
dx = pbc[0];
|
|
dy = pbc[1];
|
|
dz = pbc[2];
|
|
}
|
|
if (space==Host) {
|
|
AtomVecAtomicKokkos_PackBorder<LMPHostType,1> f(
|
|
buf.view<LMPHostType>(), k_sendlist.view<LMPHostType>(),
|
|
iswap,h_x,h_tag,h_type,h_mask,dx,dy,dz);
|
|
Kokkos::parallel_for(n,f);
|
|
} else {
|
|
AtomVecAtomicKokkos_PackBorder<LMPDeviceType,1> f(
|
|
buf.view<LMPDeviceType>(), k_sendlist.view<LMPDeviceType>(),
|
|
iswap,d_x,d_tag,d_type,d_mask,dx,dy,dz);
|
|
Kokkos::parallel_for(n,f);
|
|
}
|
|
|
|
} else {
|
|
dx = dy = dz = 0;
|
|
if (space==Host) {
|
|
AtomVecAtomicKokkos_PackBorder<LMPHostType,0> f(
|
|
buf.view<LMPHostType>(), k_sendlist.view<LMPHostType>(),
|
|
iswap,h_x,h_tag,h_type,h_mask,dx,dy,dz);
|
|
Kokkos::parallel_for(n,f);
|
|
} else {
|
|
AtomVecAtomicKokkos_PackBorder<LMPDeviceType,0> f(
|
|
buf.view<LMPDeviceType>(), k_sendlist.view<LMPDeviceType>(),
|
|
iswap,d_x,d_tag,d_type,d_mask,dx,dy,dz);
|
|
Kokkos::parallel_for(n,f);
|
|
}
|
|
}
|
|
return n*6;
|
|
}
|
|
|
|
/* ---------------------------------------------------------------------- */
|
|
|
|
template<class DeviceType>
|
|
struct AtomVecAtomicKokkos_UnpackBorder {
|
|
typedef DeviceType device_type;
|
|
|
|
const typename ArrayTypes<DeviceType>::t_xfloat_2d_const _buf;
|
|
typename ArrayTypes<DeviceType>::t_x_array _x;
|
|
typename ArrayTypes<DeviceType>::t_tagint_1d _tag;
|
|
typename ArrayTypes<DeviceType>::t_int_1d _type;
|
|
typename ArrayTypes<DeviceType>::t_int_1d _mask;
|
|
int _first;
|
|
|
|
|
|
AtomVecAtomicKokkos_UnpackBorder(
|
|
const typename ArrayTypes<DeviceType>::t_xfloat_2d_const &buf,
|
|
typename ArrayTypes<DeviceType>::t_x_array &x,
|
|
typename ArrayTypes<DeviceType>::t_tagint_1d &tag,
|
|
typename ArrayTypes<DeviceType>::t_int_1d &type,
|
|
typename ArrayTypes<DeviceType>::t_int_1d &mask,
|
|
const int& first):
|
|
_buf(buf),_x(x),_tag(tag),_type(type),_mask(mask),_first(first) {
|
|
};
|
|
|
|
KOKKOS_INLINE_FUNCTION
|
|
void operator() (const int& i) const {
|
|
_x(i+_first,0) = _buf(i,0);
|
|
_x(i+_first,1) = _buf(i,1);
|
|
_x(i+_first,2) = _buf(i,2);
|
|
_tag(i+_first) = (tagint) d_ubuf(_buf(i,3)).i;
|
|
_type(i+_first) = (int) d_ubuf(_buf(i,4)).i;
|
|
_mask(i+_first) = (int) d_ubuf(_buf(i,5)).i;
|
|
// printf("%i %i %lf %lf %lf %i BORDER\n",_tag(i+_first),i+_first,_x(i+_first,0),_x(i+_first,1),_x(i+_first,2),_type(i+_first));
|
|
}
|
|
};
|
|
|
|
/* ---------------------------------------------------------------------- */
|
|
|
|
void AtomVecAtomicKokkos::unpack_border_kokkos(const int &n, const int &first,
|
|
const DAT::tdual_xfloat_2d &buf,ExecutionSpace space) {
|
|
atomKK->modified(space,X_MASK|TAG_MASK|TYPE_MASK|MASK_MASK);
|
|
while (first+n >= nmax) grow(0);
|
|
atomKK->modified(space,X_MASK|TAG_MASK|TYPE_MASK|MASK_MASK);
|
|
if (space==Host) {
|
|
struct AtomVecAtomicKokkos_UnpackBorder<LMPHostType> f(buf.view<LMPHostType>(),h_x,h_tag,h_type,h_mask,first);
|
|
Kokkos::parallel_for(n,f);
|
|
} else {
|
|
struct AtomVecAtomicKokkos_UnpackBorder<LMPDeviceType> f(buf.view<LMPDeviceType>(),d_x,d_tag,d_type,d_mask,first);
|
|
Kokkos::parallel_for(n,f);
|
|
}
|
|
}
|
|
|
|
/* ---------------------------------------------------------------------- */
|
|
|
|
template<class DeviceType>
|
|
struct AtomVecAtomicKokkos_PackExchangeFunctor {
|
|
typedef DeviceType device_type;
|
|
typedef ArrayTypes<DeviceType> AT;
|
|
typename AT::t_x_array_randomread _x;
|
|
typename AT::t_v_array_randomread _v;
|
|
typename AT::t_tagint_1d_randomread _tag;
|
|
typename AT::t_int_1d_randomread _type;
|
|
typename AT::t_int_1d_randomread _mask;
|
|
typename AT::t_imageint_1d_randomread _image;
|
|
typename AT::t_x_array _xw;
|
|
typename AT::t_v_array _vw;
|
|
typename AT::t_tagint_1d _tagw;
|
|
typename AT::t_int_1d _typew;
|
|
typename AT::t_int_1d _maskw;
|
|
typename AT::t_imageint_1d _imagew;
|
|
|
|
typename AT::t_xfloat_2d_um _buf;
|
|
typename AT::t_int_1d_const _sendlist;
|
|
typename AT::t_int_1d_const _copylist;
|
|
int _nlocal,_dim;
|
|
X_FLOAT _lo,_hi;
|
|
|
|
AtomVecAtomicKokkos_PackExchangeFunctor(
|
|
const AtomKokkos* atom,
|
|
const typename AT::tdual_xfloat_2d buf,
|
|
typename AT::tdual_int_1d sendlist,
|
|
typename AT::tdual_int_1d copylist,int nlocal, int dim,
|
|
X_FLOAT lo, X_FLOAT hi):
|
|
_x(atom->k_x.view<DeviceType>()),
|
|
_v(atom->k_v.view<DeviceType>()),
|
|
_tag(atom->k_tag.view<DeviceType>()),
|
|
_type(atom->k_type.view<DeviceType>()),
|
|
_mask(atom->k_mask.view<DeviceType>()),
|
|
_image(atom->k_image.view<DeviceType>()),
|
|
_xw(atom->k_x.view<DeviceType>()),
|
|
_vw(atom->k_v.view<DeviceType>()),
|
|
_tagw(atom->k_tag.view<DeviceType>()),
|
|
_typew(atom->k_type.view<DeviceType>()),
|
|
_maskw(atom->k_mask.view<DeviceType>()),
|
|
_imagew(atom->k_image.view<DeviceType>()),
|
|
_sendlist(sendlist.template view<DeviceType>()),
|
|
_copylist(copylist.template view<DeviceType>()),
|
|
_nlocal(nlocal),_dim(dim),
|
|
_lo(lo),_hi(hi) {
|
|
const size_t elements = 11;
|
|
const int maxsendlist = (buf.template view<DeviceType>().extent(0)*buf.template view<DeviceType>().extent(1))/elements;
|
|
|
|
buffer_view<DeviceType>(_buf,buf,maxsendlist,elements);
|
|
}
|
|
|
|
KOKKOS_INLINE_FUNCTION
|
|
void operator() (const int &mysend) const {
|
|
const int i = _sendlist(mysend);
|
|
_buf(mysend,0) = 11;
|
|
_buf(mysend,1) = _x(i,0);
|
|
_buf(mysend,2) = _x(i,1);
|
|
_buf(mysend,3) = _x(i,2);
|
|
_buf(mysend,4) = _v(i,0);
|
|
_buf(mysend,5) = _v(i,1);
|
|
_buf(mysend,6) = _v(i,2);
|
|
_buf(mysend,7) = d_ubuf(_tag[i]).d;
|
|
_buf(mysend,8) = d_ubuf(_type[i]).d;
|
|
_buf(mysend,9) = d_ubuf(_mask[i]).d;
|
|
_buf(mysend,10) = d_ubuf(_image[i]).d;
|
|
const int j = _copylist(mysend);
|
|
|
|
if (j>-1) {
|
|
_xw(i,0) = _x(j,0);
|
|
_xw(i,1) = _x(j,1);
|
|
_xw(i,2) = _x(j,2);
|
|
_vw(i,0) = _v(j,0);
|
|
_vw(i,1) = _v(j,1);
|
|
_vw(i,2) = _v(j,2);
|
|
_tagw[i] = _tag(j);
|
|
_typew[i] = _type(j);
|
|
_maskw[i] = _mask(j);
|
|
_imagew[i] = _image(j);
|
|
}
|
|
}
|
|
};
|
|
|
|
/* ---------------------------------------------------------------------- */
|
|
|
|
int AtomVecAtomicKokkos::pack_exchange_kokkos(const int &nsend,DAT::tdual_xfloat_2d &k_buf, DAT::tdual_int_1d k_sendlist,DAT::tdual_int_1d k_copylist,ExecutionSpace space,int dim,X_FLOAT lo,X_FLOAT hi )
|
|
{
|
|
if (nsend > (int) (k_buf.view<LMPHostType>().extent(0)*k_buf.view<LMPHostType>().extent(1))/11) {
|
|
int newsize = nsend*11/k_buf.view<LMPHostType>().extent(1)+1;
|
|
k_buf.resize(newsize,k_buf.view<LMPHostType>().extent(1));
|
|
}
|
|
if (space == Host) {
|
|
AtomVecAtomicKokkos_PackExchangeFunctor<LMPHostType> f(atomKK,k_buf,k_sendlist,k_copylist,atom->nlocal,dim,lo,hi);
|
|
Kokkos::parallel_for(nsend,f);
|
|
return nsend*11;
|
|
} else {
|
|
AtomVecAtomicKokkos_PackExchangeFunctor<LMPDeviceType> f(atomKK,k_buf,k_sendlist,k_copylist,atom->nlocal,dim,lo,hi);
|
|
Kokkos::parallel_for(nsend,f);
|
|
return nsend*11;
|
|
}
|
|
}
|
|
|
|
/* ---------------------------------------------------------------------- */
|
|
|
|
template<class DeviceType>
|
|
struct AtomVecAtomicKokkos_UnpackExchangeFunctor {
|
|
typedef DeviceType device_type;
|
|
typedef ArrayTypes<DeviceType> AT;
|
|
typename AT::t_x_array _x;
|
|
typename AT::t_v_array _v;
|
|
typename AT::t_tagint_1d _tag;
|
|
typename AT::t_int_1d _type;
|
|
typename AT::t_int_1d _mask;
|
|
typename AT::t_imageint_1d _image;
|
|
|
|
typename AT::t_xfloat_2d_um _buf;
|
|
typename AT::t_int_1d _nlocal;
|
|
int _dim;
|
|
X_FLOAT _lo,_hi;
|
|
|
|
AtomVecAtomicKokkos_UnpackExchangeFunctor(
|
|
const AtomKokkos* atom,
|
|
const typename AT::tdual_xfloat_2d buf,
|
|
typename AT::tdual_int_1d nlocal,
|
|
int dim, X_FLOAT lo, X_FLOAT hi):
|
|
_x(atom->k_x.view<DeviceType>()),
|
|
_v(atom->k_v.view<DeviceType>()),
|
|
_tag(atom->k_tag.view<DeviceType>()),
|
|
_type(atom->k_type.view<DeviceType>()),
|
|
_mask(atom->k_mask.view<DeviceType>()),
|
|
_image(atom->k_image.view<DeviceType>()),
|
|
_nlocal(nlocal.template view<DeviceType>()),_dim(dim),
|
|
_lo(lo),_hi(hi) {
|
|
const size_t elements = 11;
|
|
const int maxsendlist = (buf.template view<DeviceType>().extent(0)*buf.template view<DeviceType>().extent(1))/elements;
|
|
|
|
buffer_view<DeviceType>(_buf,buf,maxsendlist,elements);
|
|
}
|
|
|
|
KOKKOS_INLINE_FUNCTION
|
|
void operator() (const int &myrecv) const {
|
|
X_FLOAT x = _buf(myrecv,_dim+1);
|
|
if (x >= _lo && x < _hi) {
|
|
int i = Kokkos::atomic_fetch_add(&_nlocal(0),1);
|
|
_x(i,0) = _buf(myrecv,1);
|
|
_x(i,1) = _buf(myrecv,2);
|
|
_x(i,2) = _buf(myrecv,3);
|
|
_v(i,0) = _buf(myrecv,4);
|
|
_v(i,1) = _buf(myrecv,5);
|
|
_v(i,2) = _buf(myrecv,6);
|
|
_tag[i] = (tagint) d_ubuf(_buf(myrecv,7)).i;
|
|
_type[i] = (int) d_ubuf(_buf(myrecv,8)).i;
|
|
_mask[i] = (int) d_ubuf(_buf(myrecv,9)).i;
|
|
_image[i] = (imageint) d_ubuf(_buf(myrecv,10)).i;
|
|
}
|
|
}
|
|
};
|
|
|
|
/* ---------------------------------------------------------------------- */
|
|
|
|
int AtomVecAtomicKokkos::unpack_exchange_kokkos(DAT::tdual_xfloat_2d &k_buf,int nrecv,int nlocal,int dim,X_FLOAT lo,X_FLOAT hi,ExecutionSpace space) {
|
|
while (nlocal + nrecv/11 >= nmax) grow(0);
|
|
|
|
if (space == Host) {
|
|
k_count.h_view(0) = nlocal;
|
|
AtomVecAtomicKokkos_UnpackExchangeFunctor<LMPHostType> f(atomKK,k_buf,k_count,dim,lo,hi);
|
|
Kokkos::parallel_for(nrecv/11,f);
|
|
return k_count.h_view(0);
|
|
} else {
|
|
k_count.h_view(0) = nlocal;
|
|
k_count.modify<LMPHostType>();
|
|
k_count.sync<LMPDeviceType>();
|
|
AtomVecAtomicKokkos_UnpackExchangeFunctor<LMPDeviceType> f(atomKK,k_buf,k_count,dim,lo,hi);
|
|
Kokkos::parallel_for(nrecv/11,f);
|
|
k_count.modify<LMPDeviceType>();
|
|
k_count.sync<LMPHostType>();
|
|
|
|
return k_count.h_view(0);
|
|
}
|
|
}
|
|
|
|
/* ---------------------------------------------------------------------- */
|
|
|
|
void AtomVecAtomicKokkos::sync(ExecutionSpace space, unsigned int mask)
|
|
{
|
|
if (space == Device) {
|
|
if (mask & X_MASK) atomKK->k_x.sync<LMPDeviceType>();
|
|
if (mask & V_MASK) atomKK->k_v.sync<LMPDeviceType>();
|
|
if (mask & F_MASK) atomKK->k_f.sync<LMPDeviceType>();
|
|
if (mask & TAG_MASK) atomKK->k_tag.sync<LMPDeviceType>();
|
|
if (mask & TYPE_MASK) atomKK->k_type.sync<LMPDeviceType>();
|
|
if (mask & MASK_MASK) atomKK->k_mask.sync<LMPDeviceType>();
|
|
if (mask & IMAGE_MASK) atomKK->k_image.sync<LMPDeviceType>();
|
|
} else {
|
|
if (mask & X_MASK) atomKK->k_x.sync<LMPHostType>();
|
|
if (mask & V_MASK) atomKK->k_v.sync<LMPHostType>();
|
|
if (mask & F_MASK) atomKK->k_f.sync<LMPHostType>();
|
|
if (mask & TAG_MASK) atomKK->k_tag.sync<LMPHostType>();
|
|
if (mask & TYPE_MASK) atomKK->k_type.sync<LMPHostType>();
|
|
if (mask & MASK_MASK) atomKK->k_mask.sync<LMPHostType>();
|
|
if (mask & IMAGE_MASK) atomKK->k_image.sync<LMPHostType>();
|
|
}
|
|
}
|
|
|
|
/* ---------------------------------------------------------------------- */
|
|
|
|
void AtomVecAtomicKokkos::sync_overlapping_device(ExecutionSpace space, unsigned int mask)
|
|
{
|
|
if (space == Device) {
|
|
if ((mask & X_MASK) && atomKK->k_x.need_sync<LMPDeviceType>())
|
|
perform_async_copy<DAT::tdual_x_array>(atomKK->k_x,space);
|
|
if ((mask & V_MASK) && atomKK->k_v.need_sync<LMPDeviceType>())
|
|
perform_async_copy<DAT::tdual_v_array>(atomKK->k_v,space);
|
|
if ((mask & F_MASK) && atomKK->k_f.need_sync<LMPDeviceType>())
|
|
perform_async_copy<DAT::tdual_f_array>(atomKK->k_f,space);
|
|
if ((mask & TAG_MASK) && atomKK->k_tag.need_sync<LMPDeviceType>())
|
|
perform_async_copy<DAT::tdual_tagint_1d>(atomKK->k_tag,space);
|
|
if ((mask & TYPE_MASK) && atomKK->k_type.need_sync<LMPDeviceType>())
|
|
perform_async_copy<DAT::tdual_int_1d>(atomKK->k_type,space);
|
|
if ((mask & MASK_MASK) && atomKK->k_mask.need_sync<LMPDeviceType>())
|
|
perform_async_copy<DAT::tdual_int_1d>(atomKK->k_mask,space);
|
|
if ((mask & IMAGE_MASK) && atomKK->k_image.need_sync<LMPDeviceType>())
|
|
perform_async_copy<DAT::tdual_imageint_1d>(atomKK->k_image,space);
|
|
} else {
|
|
if ((mask & X_MASK) && atomKK->k_x.need_sync<LMPHostType>())
|
|
perform_async_copy<DAT::tdual_x_array>(atomKK->k_x,space);
|
|
if ((mask & V_MASK) && atomKK->k_v.need_sync<LMPHostType>())
|
|
perform_async_copy<DAT::tdual_v_array>(atomKK->k_v,space);
|
|
if ((mask & F_MASK) && atomKK->k_f.need_sync<LMPHostType>())
|
|
perform_async_copy<DAT::tdual_f_array>(atomKK->k_f,space);
|
|
if ((mask & TAG_MASK) && atomKK->k_tag.need_sync<LMPHostType>())
|
|
perform_async_copy<DAT::tdual_tagint_1d>(atomKK->k_tag,space);
|
|
if ((mask & TYPE_MASK) && atomKK->k_type.need_sync<LMPHostType>())
|
|
perform_async_copy<DAT::tdual_int_1d>(atomKK->k_type,space);
|
|
if ((mask & MASK_MASK) && atomKK->k_mask.need_sync<LMPHostType>())
|
|
perform_async_copy<DAT::tdual_int_1d>(atomKK->k_mask,space);
|
|
if ((mask & IMAGE_MASK) && atomKK->k_image.need_sync<LMPHostType>())
|
|
perform_async_copy<DAT::tdual_imageint_1d>(atomKK->k_image,space);
|
|
}
|
|
}
|
|
|
|
/* ---------------------------------------------------------------------- */
|
|
|
|
void AtomVecAtomicKokkos::modified(ExecutionSpace space, unsigned int mask)
|
|
{
|
|
if (space == Device) {
|
|
if (mask & X_MASK) atomKK->k_x.modify<LMPDeviceType>();
|
|
if (mask & V_MASK) atomKK->k_v.modify<LMPDeviceType>();
|
|
if (mask & F_MASK) atomKK->k_f.modify<LMPDeviceType>();
|
|
if (mask & TAG_MASK) atomKK->k_tag.modify<LMPDeviceType>();
|
|
if (mask & TYPE_MASK) atomKK->k_type.modify<LMPDeviceType>();
|
|
if (mask & MASK_MASK) atomKK->k_mask.modify<LMPDeviceType>();
|
|
if (mask & IMAGE_MASK) atomKK->k_image.modify<LMPDeviceType>();
|
|
} else {
|
|
if (mask & X_MASK) atomKK->k_x.modify<LMPHostType>();
|
|
if (mask & V_MASK) atomKK->k_v.modify<LMPHostType>();
|
|
if (mask & F_MASK) atomKK->k_f.modify<LMPHostType>();
|
|
if (mask & TAG_MASK) atomKK->k_tag.modify<LMPHostType>();
|
|
if (mask & TYPE_MASK) atomKK->k_type.modify<LMPHostType>();
|
|
if (mask & MASK_MASK) atomKK->k_mask.modify<LMPHostType>();
|
|
if (mask & IMAGE_MASK) atomKK->k_image.modify<LMPHostType>();
|
|
}
|
|
}
|