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Add Twist Averaging to normal QMCPACK #5

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rcclay opened this issue May 5, 2017 · 0 comments
Open

Add Twist Averaging to normal QMCPACK #5

rcclay opened this issue May 5, 2017 · 0 comments

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@rcclay
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rcclay commented May 5, 2017

Twist averaging needed for CEIMC. Best handled within standard QMCPACK than on the CEIMC side. Suggest hijacking current methods for doing MPI groups, and including an MPI_reduce call, plus some logic to dump samples into a twist averaged scalar.dat file.
rcclay pushed a commit that referenced this issue Sep 17, 2019
@PDoakORNL
Merge pull request #5 from PDoakORNL/initialize-walker-position-from-…
fb24ae4 
…ref-ParticleSet

Fix batched VMC driver advanceWalkers.
rcclay pushed a commit that referenced this issue Dec 14, 2023
@jptowns
Merge pull request #5 from ye-luo/change-type
ab955c4 
Change myVarsFull_ to ValueType
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@rcclay