Commits

Commit history

1. Commits on Mar 22, 2023

   • Added function to allow access of external potential outside of adsorption isotherm for Pore3D. Requires documentation and cleanup.

     g-bauer

     committed
     7f8e600View commit details

     Copy full SHA for 7f8e600

     View code at this pointBrowse repository at this point
2. Commits on Mar 1, 2023

   • Enthalpy of adsorption (#135)

     prehner

     authored
     58b608eView commit details

     Copy full SHA for 58b608e

     View code at this pointBrowse repository at this point
3. Commits on Feb 24, 2023

   • Partial derivatives of density profiles

     prehner

     committed
     949ce5dView commit details

     Copy full SHA for 949ce5d

     View code at this pointBrowse repository at this point
4. Commits on Jan 26, 2023

   • removed enum default args for text_signature (#122)

     g-bauer

     authored
     fd3de71View commit details

     Copy full SHA for fd3de71

     View code at this pointBrowse repository at this point
5. Commits on Jan 24, 2023

   • Update pyO3 to 0.18 (#119)

     Show description for b5ea3b7
     

     g-bauer

     and

     prehner

     authored
     b5ea3b7View commit details

     Copy full SHA for b5ea3b7

     View code at this pointBrowse repository at this point
6. Commits on Jan 20, 2023

   • Remove unit generics (#115)

     Show description for 6b5c56a
     g-bauer

     authored
     6b5c56aView commit details

     Copy full SHA for 6b5c56a

     View code at this pointBrowse repository at this point
7. Commits on Dec 4, 2022

   • Implement Newton DFT solver (#75)

     prehner

     authored
     d0127e1View commit details

     Copy full SHA for d0127e1

     View code at this pointBrowse repository at this point
8. Commits on Dec 1, 2022

   • Relative adsorption, interfacial enrichment, and interface thickness. (#64)

     Show description for 8f0ebcc
     

     RolfStierle

     and

     Rolf Stierle

     authored
     8f0ebccView commit details

     Copy full SHA for 8f0ebcc

     View code at this pointBrowse repository at this point
9. Commits on Nov 11, 2022

   • Rewrite and document core DFT functionality (#60)

     Show description for 329770b
     prehner

     authored
     329770bView commit details

     Copy full SHA for 329770b

     View code at this pointBrowse repository at this point
10. Commits on Oct 18, 2022

    • Add Sync + Send to `EquationOfState` trait bounds (#57)

      Show description for 6f5d9c6
      

      g-bauer

      and

      prehner

      authored
      6f5d9c6View commit details

      Copy full SHA for 6f5d9c6

      View code at this pointBrowse repository at this point
11. Commits on Aug 26, 2022

    • Improve the robustness of adsorption isotherm calculations (#50)

      Show description for bd4280b
      prehner

      authored
      bd4280bView commit details

      Copy full SHA for bd4280b

      View code at this pointBrowse repository at this point
12. Commits on Jul 8, 2022

    • Steele potential with custom combining rules (#29)

      prehner

      authored
      ad5981cView commit details

      Copy full SHA for ad5981c

      View code at this pointBrowse repository at this point
13. Commits on Jun 13, 2022

    • Restructure FeOs project (#18)

      Show description for b3180fb
      

      prehner

      and

      g-bauer

      authored
      b3180fbView commit details

      Copy full SHA for b3180fb

      View code at this pointBrowse repository at this point
14. Loading