Skip to content

Releases: ltalirz/atomistic-software

v2026.3.25

Choose a tag to compare

@ltalirz ltalirz released this 25 Mar 20:28
416f851

2026 release of atomistic.software

  • adds 2025 citation data
  • codes added: jax-MD, torchMD, WEST, mrcc, PERTURBO, Beijing Density Functional
  • website features
    • add view to compare trends of different codes
    • switch to material-react-table
    • allow time-dependent code attributes (mostly to track license changes)
    • make filter values in overview table clickable
    • add toggle for showing cumulative data

Remarks on Google Scholar data

Some citation counts for 2025 still seem overly optimistic (e.g. VASP). To be revisited at some later time in the year

v2025.4.20

Choose a tag to compare

@ltalirz ltalirz released this 20 Apr 11:06
6d75151

2025 release of atomistic.software

  • adds 2024 citation data
  • added: GPUMD, CASINO
  • updated citation counts 2016-2023

Remarks on Google Scholar data

Citation counts for 2023 decreased by ~10% vs the 2024 release. Spot checks indicate that this may reflect a more accurate prediction of the total number of citations on the search result landing page [1], but perhaps also some change in methodology (e.g. concerning deduplication, or change in policy for what sources to include).
In the 2025 release the 2022 citation counts now appear like an outlier (too high). It remains to be seen whether this is a real effect or due to a change in methodology on the Google Scholar side that has not yet propagated through all previous years

[1] For queries with <1000 results, compare approximate number of search results shown on the search landing page vs the number obtained by clicking through to the last search result.

v2024.3.29

Choose a tag to compare

@ltalirz ltalirz released this 29 Mar 15:06
6d4b273

2024 update of atomistic.software

  • adds 2023 citation data
  • updated citation data for 2022 & 2021 (citation estimates for 2022 appear to have been corrected down a bit)
  • relax relevance criterion from 100 citations per year to 50 citations per year (i.e. ~1 citation per week)
    • added: COLUMBUS, QMCPACK, ONETEP, exciting, fleur, demon2k, ACEMD, PWMAT

2023 is the first year, where citations to free codes have overtaken those to commercial codes.

v2023.1.28

Choose a tag to compare

@ltalirz ltalirz released this 28 Jan 11:29

2023 update

v2022.2.3

Choose a tag to compare

@ltalirz ltalirz released this 03 Feb 22:25

2022 update

v2021.3.26

v2021.3.26 Pre-release
Pre-release

Choose a tag to compare

@ltalirz ltalirz released this 26 Mar 13:08

Initial release for zenodo.org