QMCPACK / QMCPACK/qmcpack

LCAO offload todo list

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Dominant language
C++
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Merged PRs (30d)
82

Description

LCAO offload.
- [ ] make mw/GEMM versions of evaluateValue and DetRatios
- [ ] offload mw_evaluateVGL and mw_evaluateVGLandDetRatioGrads
- [ ] offload mw_evaluateValue and mw_evaluateDetRatios
- [ ] offload AO evaluation (either before or after reworking AO eval algorithm)

Contributor guide

Open the contributing guide

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