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Disable allocation of per-atom arrays in ev_setup for USER-DPD Kokkos styles

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This commit is contained in:
Stan Moore
2017-03-08 13:07:52 -07:00
parent 0ce5dc0234
commit fc23f9cfe8
5 changed files with 5 additions and 5 deletions
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2
src/KOKKOS/pair_dpd_fdt_energy_kokkos.cpp
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@ -161,7 +161,7 @@ void PairDPDfdtEnergyKokkos<DeviceType>::compute(int eflag_in, int vflag_in)
vflag = vflag_in;
if (neighflag == FULL) no_virial_fdotr_compute = 1;
if (eflag || vflag) ev_setup(eflag,vflag);
if (eflag || vflag) ev_setup(eflag,vflag,0);
else evflag = vflag_fdotr = 0;
// reallocate per-atom arrays if necessary

2
src/KOKKOS/pair_exp6_rx_kokkos.cpp
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@ -127,7 +127,7 @@ void PairExp6rxKokkos<DeviceType>::compute(int eflag_in, int vflag_in)
vflag = vflag_in;
if (neighflag == FULL) no_virial_fdotr_compute = 1;
if (eflag || vflag) ev_setup(eflag,vflag);
if (eflag || vflag) ev_setup(eflag,vflag,0);
else evflag = vflag_fdotr = 0;
// reallocate per-atom arrays if necessary

2
src/KOKKOS/pair_hybrid_kokkos.cpp
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@ -77,7 +77,7 @@ void PairHybridKokkos::compute(int eflag, int vflag)
if (no_virial_fdotr_compute && vflag % 4 == 2) vflag = 1 + vflag/4 * 4;
if (eflag || vflag) ev_setup(eflag,vflag);
if (eflag || vflag) ev_setup(eflag,vflag,0);
else evflag = vflag_fdotr = eflag_global = vflag_global =
eflag_atom = vflag_atom = 0;

2
src/KOKKOS/pair_multi_lucy_rx_kokkos.cpp
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@ -147,7 +147,7 @@ void PairMultiLucyRXKokkos<DeviceType>::compute_style(int eflag_in, int vflag_in
vflag = vflag_in;
if (neighflag == FULL) no_virial_fdotr_compute = 1;
if (eflag || vflag) ev_setup(eflag,vflag);
if (eflag || vflag) ev_setup(eflag,vflag,0);
else evflag = vflag_fdotr = 0;
// reallocate per-atom arrays if necessary

2
src/KOKKOS/pair_table_rx_kokkos.cpp
View File

@ -627,7 +627,7 @@ void PairTableRXKokkos<DeviceType>::compute_style(int eflag_in, int vflag_in)
if (neighflag == FULL) no_virial_fdotr_compute = 1;
if (eflag || vflag) ev_setup(eflag,vflag);
if (eflag || vflag) ev_setup(eflag,vflag,0);
else evflag = vflag_fdotr = 0;
if (eflag_atom) {