Ecosyste.ms: Issues

An open API service for providing issue and pull request metadata for open source projects.

GitHub / juliamolsim/atomscalculatorsutilities.jl issues and pull requests

#35 - hessian needs tests

Issue - State: open - Opened by cortner about 1 month ago

#35 - hessian needs tests

Issue - State: open - Opened by cortner about 1 month ago

#34 - ipi doc update

Pull Request - State: closed - Opened by tjjarvinen about 1 month ago

#34 - ipi doc update

Pull Request - State: closed - Opened by tjjarvinen about 1 month ago

#32 - update interface to ChunkSplitters 3.0

Pull Request - State: closed - Opened by lmiq 2 months ago - 3 comments

#32 - update interface to ChunkSplitters 3.0

Pull Request - State: closed - Opened by lmiq 2 months ago - 3 comments

#31 - Add i-PI server calculator and update i-PI driver to AB v0.4

Pull Request - State: closed - Opened by tjjarvinen 2 months ago

#31 - Add i-PI server calculator and update i-PI driver to AB v0.4

Pull Request - State: closed - Opened by tjjarvinen 2 months ago

#29 - Bugfixes fd tests

Pull Request - State: closed - Opened by cortner 3 months ago

#29 - Bugfixes fd tests

Pull Request - State: closed - Opened by cortner 3 months ago

#28 - fix AtomsBase v0.4 support

Pull Request - State: closed - Opened by tjjarvinen 3 months ago

#28 - fix AtomsBase v0.4 support

Pull Request - State: closed - Opened by tjjarvinen 3 months ago

#27 - Fix IPI driver

Pull Request - State: closed - Opened by tjjarvinen 3 months ago

#27 - Fix IPI driver

Pull Request - State: closed - Opened by tjjarvinen 3 months ago

#26 - support AtomsBase v0.4

Pull Request - State: closed - Opened by tjjarvinen 3 months ago

#26 - support AtomsBase v0.4

Pull Request - State: closed - Opened by tjjarvinen 3 months ago

#25 - Update to AtomsBase 0.4

Issue - State: closed - Opened by cortner 3 months ago

#25 - Update to AtomsBase 0.4

Issue - State: closed - Opened by cortner 3 months ago

#24 - TagBot trigger issue

Issue - State: closed - Opened by JuliaTagBot 3 months ago - 6 comments

#24 - TagBot trigger issue

Issue - State: closed - Opened by JuliaTagBot 3 months ago - 6 comments

#23 - Register in General

Issue - State: open - Opened by cortner 3 months ago - 12 comments

#23 - Register in General

Issue - State: open - Opened by cortner 3 months ago - 12 comments

#21 - Update utility calculators to AtomsCalculators v0.2

Pull Request - State: closed - Opened by tjjarvinen 4 months ago

#21 - Update utility calculators to AtomsCalculators v0.2

Pull Request - State: closed - Opened by tjjarvinen 4 months ago

#18 - Switch to AtomsCalculators v0.2.x

Pull Request - State: closed - Opened by cortner 4 months ago - 2 comments

#18 - Switch to AtomsCalculators v0.2.x

Pull Request - State: closed - Opened by cortner 4 months ago - 2 comments

#16 - Updates and fixes for calculators

Pull Request - State: closed - Opened by tjjarvinen 5 months ago

#16 - Updates and fixes for calculators

Pull Request - State: closed - Opened by tjjarvinen 5 months ago

#15 - i-PI driver implementation

Pull Request - State: closed - Opened by tjjarvinen 5 months ago

#15 - i-PI driver implementation

Pull Request - State: closed - Opened by tjjarvinen 5 months ago

#14 - Merge Simple and Parameterized PairPots

Issue - State: closed - Opened by cortner 6 months ago - 1 comment

#14 - Merge Simple and Parameterized PairPots

Issue - State: closed - Opened by cortner 6 months ago - 1 comment

#13 - PairPotentials for Multiple Elements

Issue - State: closed - Opened by cortner 6 months ago - 5 comments

#12 - Type instability in PairPotential Implementation

Issue - State: closed - Opened by cortner 6 months ago - 1 comment

#11 - Discussion of ZeroVirialCalculator

Issue - State: closed - Opened by cortner 6 months ago - 3 comments

#10 - Remove abstract SitePotential and PairPotential

Issue - State: open - Opened by cortner 6 months ago

#9 - Rename `get_id`

Issue - State: open - Opened by cortner 6 months ago - 5 comments

#8 - Finite difference tests

Pull Request - State: closed - Opened by cortner 6 months ago - 21 comments

#7 - WIP: Move generic site potential codes from EP

Pull Request - State: closed - Opened by cortner 6 months ago - 7 comments

#6 - Todo List

Issue - State: closed - Opened by cortner 6 months ago - 2 comments

#5 - Move calculators to a submodule and add zero virial calculator

Pull Request - State: closed - Opened by tjjarvinen 6 months ago

#4 - Name change

Pull Request - State: closed - Opened by tjjarvinen 6 months ago

#3 - Bump julia-actions/cache from 1 to 2

Pull Request - State: closed - Opened by dependabot[bot] 7 months ago
Labels: dependencies

#2 - Bump julia-actions/setup-julia from 1 to 2

Pull Request - State: closed - Opened by dependabot[bot] 8 months ago
Labels: dependencies

#1 - basic calculators

Pull Request - State: closed - Opened by tjjarvinen 8 months ago