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double host write, wrong dpd cond

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This commit is contained in:
Eddy Barraud
2024-06-07 15:14:05 +02:00
parent afc8c752fd
commit aadeb1149d
4 changed files with 10 additions and 15 deletions
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7
lib/gpu/lal_dpd_charged.cpp
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@ -112,13 +112,8 @@ int DPDChargedT::init(const int ntypes,
this->atom->type_pack4(ntypes,lj_types,coeff,host_write,host_a0,host_gamma,
host_sigma,host_cut_dpd);
// Allocate a host write buffer for data initialization
UCL_H_Vec<numtyp> host_rsq(lj_types*lj_types*32,*(this->ucl_device),
UCL_WRITE_ONLY);
for (int i=0; i<lj_types*lj_types; i++)
host_rsq[i]=0.0;
cutsq.alloc(lj_types*lj_types,*(this->ucl_device),UCL_READ_ONLY);
this->atom->type_pack4(ntypes,lj_types,cutsq,host_rsq,host_cutsq,
this->atom->type_pack4(ntypes,lj_types,cutsq,host_write,host_cutsq,
host_cut_dpdsq, host_scale, host_cut_slatersq);
double special_sqrt[4];