| 35 |
|
* |
| 36 |
|
* [1] Meineke, et al., J. Comp. Chem. 26, 252-271 (2005). |
| 37 |
|
* [2] Fennell & Gezelter, J. Chem. Phys. 124, 234104 (2006). |
| 38 |
< |
* [3] Sun, Lin & Gezelter, J. Chem. Phys. 128, 24107 (2008). |
| 38 |
> |
* [3] Sun, Lin & Gezelter, J. Chem. Phys. 128, 234107 (2008). |
| 39 |
|
* [4] Kuang & Gezelter, J. Chem. Phys. 133, 164101 (2010). |
| 40 |
|
* [5] Vardeman, Stocker & Gezelter, J. Chem. Theory Comput. 7, 834 (2011). |
| 41 |
|
*/ |
| 42 |
– |
|
| 43 |
– |
#include "math/ParallelRandNumGen.hpp" |
| 42 |
|
#ifdef IS_MPI |
| 43 |
|
#include <mpi.h> |
| 44 |
|
#endif |
| 45 |
|
|
| 46 |
+ |
#include "math/ParallelRandNumGen.hpp" |
| 47 |
+ |
|
| 48 |
|
namespace OpenMD { |
| 49 |
|
|
| 50 |
|
int ParallelRandNumGen::nCreatedRNG_ = 0; |
| 85 |
|
|
| 86 |
|
ParallelRandNumGen::ParallelRandNumGen() { |
| 87 |
|
|
| 88 |
– |
std::vector<uint32> bigSeed; |
| 88 |
|
int nProcessors; |
| 89 |
|
#ifdef IS_MPI |
| 90 |
|
nProcessors = MPI::COMM_WORLD.Get_size(); |
| 123 |
|
void ParallelRandNumGen::seed() { |
| 124 |
|
|
| 125 |
|
std::vector<uint32> bigSeed; |
| 127 |
– |
int size; |
| 126 |
|
|
| 127 |
|
#ifdef IS_MPI |
| 128 |
+ |
int size; |
| 129 |
|
const int masterNode = 0; |
| 130 |
|
if (worldRank == masterNode) { |
| 131 |
|
#endif |
| 132 |
|
|
| 133 |
|
bigSeed = mtRand_->generateSeeds(); |
| 135 |
– |
size = bigSeed.size(); |
| 134 |
|
|
| 135 |
|
#ifdef IS_MPI |
| 136 |
+ |
size = bigSeed.size(); |
| 137 |
|
MPI::COMM_WORLD.Bcast(&size, 1, MPI::INT, masterNode); |
| 138 |
|
MPI::COMM_WORLD.Bcast(&bigSeed[0], size, MPI::UNSIGNED_LONG, masterNode); |
| 139 |
|
}else { |