mirror of https://github.com/QMCPACK/qmcpack.git
2c533a4d1b
* started adding RMG to convert4qmc * replace raw pointer with std::unique_ptr for RMGParser in convert4qmc * clang-format * updated docs for RMG converter * change supertwist handling in RMG converter * added tests for RMG converter * removed larger rmg converter test * added spin-polarized RMG converter test * add override for two RMGParser functions * added RMG ctest (WIP) * cleaned up RMG tests * shortened rmg vmc test * added rmg-diamond reference vals * minor cleanup * minor cleanup of cmake for RMG Co-authored-by: Paul R. C. Kent <kentpr@ornl.gov> |
||
|---|---|---|
| .. | ||
| gold.qmc.in-wfnoj.xml | ||
| gold.structure.xml | ||
| gold.wfnoj.xml | ||
| input | ||
| o.h5 | ||