quantumespresso:respack
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| Both sides previous revision Previous revision | Next revision Both sides next revision | ||
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quantumespresso:respack [2020/08/12 21:08] koudai [相互作用の計算] |
quantumespresso:respack [2020/08/12 21:08] koudai [分極関数の計算] |
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| $ export OMP_NUM_THREADS=12 | $ export OMP_NUM_THREADS=12 | ||
| $ export MKL_NUM_THREADS=12 | $ export MKL_NUM_THREADS=12 | ||
| - | $ mpirun -n 6 calc_chiqw < respack.in > LOG.chiqw | + | $ mpirun -n 2 calc_chiqw < respack.in > LOG.chiqw |
| </ | </ | ||
| * OpenMPとMPIのハイブリッドです。OMP_NUM_THREADSおよびMKL_NUM_THREADSにMPIの1スレッドあたりのOpenMP並列数を指定してください | * OpenMPとMPIのハイブリッドです。OMP_NUM_THREADSおよびMKL_NUM_THREADSにMPIの1スレッドあたりのOpenMP並列数を指定してください | ||
quantumespresso/respack.txt · Last modified: 2024/02/03 18:42 by koudai
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