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Organizations

@libAtoms

Popular repositories

  1. f90wrap

    F90 to Python interface generator with derived type support

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  2. AtomEye

    Modified fork of Ju Li's atomistic configuration viewer (http://li.mit.edu/Archive/Graphics/A/)

    C 21 5

  3. aps-length

    Calculate length (number of equivalent words) for APS manuscripts written with LaTeX

    Python 21 8

  4. rocket

    Simple mathematical model of water rockets trajectories

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  5. DST-FEM

    Diamond CDT Finite Element Method lectures

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  6. chemview

    Forked from gabrielelanaro/chemview

    The new generation molecular viewer for IPython notebook

    JavaScript

259 contributions in the last year

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Contribution activity

May 2019

jameskermode has no activity yet for this period.

April 2019

Created an issue in libAtoms/ASE.jl that received 3 comments

Add missing convenience wrappers for energy, force, etc.

import JuLIP.forces, JuLIP.gradient, JuLIP.energy gradient(calc::ASE.ASECalculator, at::Atoms) = gradient(calc, ASE.ASEAtoms(at)) forces(calc::ASE.…

3 comments
4 contributions in private repositories Apr 12 – Apr 30

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