Feature/gpu for energyevals - #109

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BenjaminYazdi wants to merge 20 commits into

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feature/gpu-for-energyevals

Commits on Aug 7, 2025

converted function to gpu
BenjaminYazdi
committed
f2d12d9
deleted empty line
BenjaminYazdi
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c643621

Commits on Aug 8, 2025

Update Project.toml: added cuda as a dependency
BenjaminYazdi
authored
4288975
added CUDA
BenjaminYazdi
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ff8178f
Merge branch 'feature/gpu-for-energyevals' of https://github.com/wexlergroup/FreeBird.jl into feature/gpu-for-energyevals
BenjaminYazdi
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1a84ec3
deleted extraneous cuda line
BenjaminYazdi
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fba1940
fixed epsilon and sigma types
BenjaminYazdi
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adc6f89
ustrip-ed to give a unitless Float64 value
BenjaminYazdi
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becb7e1
edited cell line to get around atomsbase issue
BenjaminYazdi
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4665089
edited cell def to avoid atomsbase issue
BenjaminYazdi
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8639d65
trying to fix cell definition
BenjaminYazdi
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6ff0393
trying to fix cell def
BenjaminYazdi
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72ed6ff
trying to fix cell
BenjaminYazdi
committed
d242140

Commits on Aug 11, 2025

fix cell definition
BenjaminYazdi
committed
44828de
edited cell def
BenjaminYazdi
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8769d03
edit cell
BenjaminYazdi
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fec53a9
edited cell
BenjaminYazdi
committed
2196c69
edited cell
BenjaminYazdi
committed
723ba30

Commits on Aug 12, 2025