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Pull requests: deepmodeling/DeePTB

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Pull requests list

feat: Support SOC for overlap, add --soc option in esk, add uniform_noref method for SOC and support s/p/d type for SOC
#271 opened Aug 26, 2025 by xdzhu Loading…
Fix orthogonalization in eigh Bug Report Something isn't working
#270 opened Aug 22, 2025 by AsymmetryChou Loading…
@AsymmetryChou
2
build(deps): bump actions/checkout from 4 to 5 dependencies Pull requests that update a dependency file github_actions Pull requests that update GitHub Actions code
#269 opened Aug 12, 2025 by dependabot bot Loading…
Fix bug so2
#267 opened Aug 4, 2025 by floatingCatty Loading…
1
Accond
#251 opened May 22, 2025 by QG-phy Loading…
Efficient Block-Diagonal Matrix Operations for Wigner D Computation
#250 opened May 21, 2025 by Kai-Qi Loading…
10
add Spline decay support for large off diagonal elements
#221 opened Jan 5, 2025 by floatingCatty Loading…
Poisson-dev and support for BTD and Overlap Matrix in NEGF
#105 opened Apr 1, 2024 by AsymmetryChou Loading…
23
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