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Merge pull request #2783 from prckent/log
Update changelog ahead of release
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CHANGELOG.md

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@@ -4,8 +4,37 @@ Notable changes to QMCPACK are documented in this file.
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## [Unreleased]
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### Notes
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This release contains multiple feature improvements and bug fixes. The AFQMC implementation has been significantly enhanced, and
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an important wavefunction optimization bug fixed in real space QMC.
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* The QMCPACK manual is now available at https://qmcpack.readthedocs.io, having been converted to use reStructuredText and the sphinx
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documentation system.
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* Significant improvements to the AFQMC code including HIP support for AMD GPUs, updated documentation, and support for non-collinear calculations and spin-orbit k-point Hamiltonians
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[\#2734](https://github.com/QMCPACK/qmcpack/pull/2734).
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* Improved support for spin-orbit in real-space QMC including documentation [\#2733](https://github.com/QMCPACK/qmcpack/pull/2733).
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* Important bug fix for wavefunction optimization in few electron systems such as isolated atoms. The bug would result in slow or no
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convergence. Thanks to Jaron Krogel and Matus Dubecky for reports and reproducers.
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[\#2496](https://github.com/QMCPACK/qmcpack/issues/2496).
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* Implementation of L2 potentials and evaluation in DMC [\#1948](https://github.com/QMCPACK/qmcpack/pull/1948).
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* Consistent with our two year support policy for open source compilers, libraries, and tooling, several version minimums have
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been increased to either avoid bugs or to utilize new features.
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* Clang 7 is the earliest supported Clang compiler. The latest release is recommended.
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* Intel 2019 is the earliest supported Intel compiler. The latest release is recommended.
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* Future releases of QMCPACK will require C++17. The current minimum is C++14.
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* AoS builds are no longer supported. The code has been removed now that the default structures-of-arrays (SoA) build has
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sufficiently broad capability.
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* The default CUDA architecture is set to sm_70 (Volta).
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* AoS builds are no longer supported. The code has been removed.
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* QMCPACK is built with ENABLE_TIMERS=ON by default [\#2663](https://github.com/QMCPACK/qmcpack/issues/2663)
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* Various bug fixes to complete the transition to Python 3.
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* Ongoing improvements to the OpenMP offload implementation.
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### NEXUS
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* NEXUS manual is now available at https://nexus-workflows.readthedocs.io, having been converted to use the reStructuredText and sphinx
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documentation system.
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* Various small fixes and improvements.
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## [3.9.2] - 2020-04-29
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