QMCPACK / miniqmc

QMCPACK miniapp: a simplified real space QMC code for algorithm development, performance portability testing, and computer science experiments
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Update MPI and MKL as QMCPACK #258

Closed ye-luo closed 3 years ago

ye-luo commented 3 years ago

Test this please

ye-luo commented 3 years ago

Q. How is VML handled now?

We don't need VML in miniQMC. So it is better to not keep it around in miniQMC and adopt it from QMCPACK when the need comes. In QMCPACK, SIMD and Vector math still need improvements.