Papers



Submit a Paper!

Browse ReproHack papers

  • Accelerating the prediction of large carbon clusters via structure search: Evaluation of machine-learning and classical potentials

    Authors: Bora Karasulu, Jean-Marc Leyssale, Patrick Rowe, Cedric Weber, Carla de Tomas
    DOI: 10.1016/j.carbon.2022.01.031
    Submitted by bkarasulu    
    Number of reviews:   1
    Why should we attempt to reproduce this paper?

    This paper presents a fine example of high-throughput computational materials screening studies, mainly focusing on the carbon nanoclusters of different sizes. In the paper, a set of diverse empirical and machine-learned interatomic potentials, which are commonly used to simulate carbonaceous materials, is benchmarked against the higher-level density functional theory (DFT) data, using a range of diverse structural features as the comparison criteria. Trying to reproduce the data presented here (even if you only consider a subset of the interaction potentials) will help you devise an understanding as to how you could approach a high-throughput structure prediction problem. Even though we concentrate here on isolated/finite nanoclusters, AIRSS (and other similar approaches like USPEX, CALYPSO, GMIN, etc.,) can also be used to predict crystal structures of different class of materials with applications in energy storage, catalysis, hydrogen storage, and so on.

  • The Impact of Sound-Bite Journalism on Public Argument

    Authors: Rinke, E. M.
    DOI: 10.1111/jcom.12246
    Submitted by emrinke    
      Mean reproducibility score:   10.0/10   |   Number of reviews:   1
    Why should we attempt to reproduce this paper?

    - This paper is a good example of a standard social science study that is (I hope!) fully reproducible, from main analysis, to supplementary analyses and figures. - I have not yet received any external feedback w.r.t. its reproducibility, so would be interested to see if I have overlooked any gaps in the reproduction workflow that I anticipated.

Search for papers

Filter by tags

Python R ArcGIS make Docker Drake Shiny LaTeX SVN knitr HPC Computer Science C Matlab Mathematica Stata Meta-analysis GDAL GEOS GIS PROJ Social Science swig miniconda neuroscience Jupyter Notebook tensorflow keras Pandas SQL Galaxies Astronomy Databases Binder tidyverse emacs literate earth sciences clumped isotopes org-mode geology eyetracking Git robotics deep learning planner reiforcement learning Plasma physics Hybrid-PIC EPOCH Laser Gamma-ray X-ray radiation Petawatt Fortran plasma PIC physics Monte Carlo Atomistic Simulation LAMMPS Electron Transport DFT descriptors interatomic potentials machine learning Molecular Dynamics Python scripting AIRSS structure prediction density functional theory high-throughput machine-learning RNA bioinformatics CFD Fluid Dynamics OpenFOAM C++ DNS Mathematics Droplets Basilisk Particle-In-Cell psychology consumer behavior number estimation mental arithmetic psychophysics Stan Finance SAS Replication crisis Economics Malaria Archaeology Precipitation Epidemiology Parkrun Health Health Economics HTA plumber science of science Zipf networks city size distribution urbanism literature review Preference Visual Questionnaire Mann-Whitney Correlation Conceptual replication Cognitive psychology Multinomial processing tree (MPT) modeling #urbanism #R k-means cluster analysis city-regions Urban Knowledge Systems Topic modelling Planning Support Systems Software Citation Quarto snakemake Numerical modelling Ocean climate physical oceanography apptainer oceanography R package structural equation modeling bayes factor Forest Simulations Models of forest dynamics multi-lab study mice mechanics growth Tissue Cells Clustering Expectation-Maximization bootstrapping R software Position Weight Matrices singularity neuroimaging effect size biology replicability cancer reproducibility csv osf preclinical research genomics All tags Clear tags

Key

  Associated with an event
  Available for general review
  Public reviews welcome