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Pull requests: NQCD/NQCDynamics.jl

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Pull requests list

CompatHelper: bump compat for StructArrays to 0.7, (keep existing compat)
#358 opened Nov 17, 2024 by github-actions bot Loading…
Moving general surface hopping functions to SurfaceHoppingMethods.jl
#357 opened Nov 1, 2024 by Ash-Baldwin Loading…
3
CompatHelper: bump compat for NQCModels to 0.9, (keep existing compat)
#352 opened Aug 15, 2024 by github-actions bot Loading…
Draft: Phonon thermostat
#349 opened Jul 22, 2024 by Alexsp32 • Draft
3 tasks
Version 1.0.0
@Alexsp32
Draft: Julia-based MACE interface for more efficient ring-polymer simulations
#346 opened Jul 15, 2024 by Alexsp32 • Draft
@Alexsp32
CompatHelper: bump compat for FastBroadcast to 0.3, (keep existing compat)
#343 opened May 25, 2024 by github-actions bot Loading…
Create Boltzmann velocity distributions from Simulations directly
#332 opened Feb 7, 2024 by Alexsp32 Loading…
1
2
CompatHelper: bump compat for RecursiveArrayTools to 3, (keep existing compat)
#327 opened Dec 13, 2023 by github-actions bot Loading…
Added some comments and test example
#326 opened Dec 11, 2023 by Louhokseson Loading…
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