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Pull requests: QMCPACK/qmcpack

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Pull requests list

[WIP] Batched converter
#5231 opened Nov 15, 2024 by anbenali Loading…
1
Nexus new hubbard format in QE with nearest neighbors
#5230 opened Nov 14, 2024 by kayahans Loading…
[Multi] make changes to rely on ADL get instead of std::get
#5228 opened Nov 14, 2024 by correaa Loading…
4
Drop FindBoost module which is deprecated in CMake 3.30 and raise minimum version to 1.70.
#5227 opened Nov 13, 2024 by ye-luo Loading…
8
[WIP] Nexus: prototype NumPy 2 support nexus
#5215 opened Nov 9, 2024 by prckent Loading…
1
Nexus example for specifying estimators
#5214 opened Nov 8, 2024 by aannabe Loading…
24
dump walkers periodically for post-processing help wanted
#4940 opened Mar 13, 2024 by Paul-St-Young Loading…
@Paul-St-Young
14
[WIP] Add cusp correction based on atomic orbitals
#4901 opened Jan 16, 2024 by markdewing • Draft
nexus rmg updates
#4747 opened Sep 26, 2023 by kgasperich Loading…
3 tasks done
@kgasperich @anbenali
9
[WIP] Soa spherical tensor
#4714 opened Aug 25, 2023 by anbenali Loading…
6
Make SPOSet a class template
#4685 opened Jul 24, 2023 by ye-luo Loading…
8
Implement SPOSetT<T> template class hierarchy
#4684 opened Jul 24, 2023 by williamfgc Loading…
39
Don't allow batched version to accept hamiltonian estimator input
#4643 opened Jun 22, 2023 by PDoakORNL Loading…
22
[WIP] Remove Observable Helper
#4540 opened Apr 4, 2023 by PDoakORNL • Draft
4
convert h5 orbs from spherical to Cartesian
#4364 opened Dec 14, 2022 by kgasperich Loading…
6
Build script and Nexus support for CSCS Piz Daint
#4068 opened Jun 20, 2022 by zenandrea Loading…
11
[Preview] Add QMC_GPU=no/NVIDIA/AMD/INTEL
#3930 opened Apr 6, 2022 by ye-luo • Draft
12
[WIP] Anisotropic Ewald code
#2182 opened Jan 3, 2020 by jtkrogel Loading…
26
[WIP] Change RNG seed generation scheme. in progress
#1174 opened Nov 27, 2018 by ye-luo Loading…
@ye-luo
5
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