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JuliaMolSim
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AtomsCalculatorsUtilities.jl
MIT License
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CompatHelper: bump compat for AtomsCalculators to 0.2, (keep existing compat)
#17
github-actions[bot]
opened
6 days ago
0
Updates and fixes for calculators
#16
tjjarvinen
closed
2 weeks ago
0
i-PI driver implementation
#15
tjjarvinen
closed
3 weeks ago
0
Merge Simple and Parameterized PairPots
#14
cortner
opened
1 month ago
0
PairPotentials for Multiple Elements
#13
cortner
opened
1 month ago
4
Type instability in PairPotential Implementation
#12
cortner
opened
1 month ago
0
Discussion of ZeroVirialCalculator
#11
cortner
opened
1 month ago
2
Remove AbstractSitePotential
#10
cortner
opened
1 month ago
0
Rename `get_id`
#9
cortner
opened
1 month ago
0
Finite difference tests
#8
cortner
closed
1 month ago
21
WIP: Move generic site potential codes from EP
#7
cortner
opened
1 month ago
5
Todo List
#6
cortner
opened
1 month ago
0
Move calculators to a submodule and add zero virial calculator
#5
tjjarvinen
closed
1 month ago
0
Name change
#4
tjjarvinen
closed
1 month ago
0
Bump julia-actions/cache from 1 to 2
#3
dependabot[bot]
closed
1 month ago
0
Bump julia-actions/setup-julia from 1 to 2
#2
dependabot[bot]
closed
1 month ago
0
basic calculators
#1
tjjarvinen
closed
1 month ago
0