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NVE energy conservation in neighbor rebuilds
- #153
#153
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dallasfoster
merged 4 commits into
NVIDIA:0.2.0-rc
NVIDIA/nvalchemi-toolkit:0.2.0-rc
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laserkelvin:151-nve-conservation
laserkelvin/nvalchemi-toolkit:151-nve-conservation
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Aug 6, 2026
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NVE energy conservation in neighbor rebuilds
#153
dallasfoster
merged 4 commits into
NVIDIA:0.2.0-rc
NVIDIA/nvalchemi-toolkit:0.2.0-rc
from
laserkelvin:151-nve-conservation
laserkelvin/nvalchemi-toolkit:151-nve-conservation
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Commits on Jul 28, 2026
fix(hooks): rebuild neighbor lists after periodic wrapping
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test(hooks): add NVE conservation regression
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refactor(hooks): use ops rebuild binding
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refactor(hooks): simplify rebuild import
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