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Support python3.13#4100

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DanielYang59 wants to merge 30 commits intomaterialsproject:mastermaterialsproject/pymatgen:masterfrom DanielYang59:support-python313DanielYang59/pymatgen:support-python313Copy head branch name to clipboard

+20-19

Commits

Commits on Oct 10, 2024

• explicitly test 3.13 in test workflow

  DanielYang59

  committed
  2ca9d02

• add 3.13 classifier

  DanielYang59

  committed
  47b4cde

• drop install for openff-toolkit for now

  DanielYang59

  committed
  bb4554d

• bump chgnet to support numpy 2

  DanielYang59

  committed
  3661359

• loose torch pin

  DanielYang59

  committed
  7a8d6ff

• try to remove manual install of torch

  DanielYang59

  committed
  f3176b4

• bump github action version

  DanielYang59

  committed
  02fbe6a

• revert bump of chgnet version

  DanielYang59

  committed
  249821b

• bump chgnet to 0.4.0 to support np2

  DanielYang59

  committed
  2673ce1

• migrate deprecated config

  DanielYang59

  committed
  dc47253

• pin python < 3.13 for chgnet and matgl

  DanielYang59

  committed
  300f4e4

• try to exclude some python313 incompatible packages

  DanielYang59

  committed
  464defe

• should work for python 3.13 now

  DanielYang59

  committed
  d01bf59

• revert migrated changes

  DanielYang59

  committed
  16caa14

• NEED CONFIRM: bump numpy to 1.26.2 to support python 3.13

  DanielYang59

  committed
  5fb01a7

• bump h5py to support python 3.13

  DanielYang59

  committed
  960a44b

• bump scipy to support python 3.13

  DanielYang59

  committed
  a8a765a

Commits on Nov 19, 2024

• merge master

  DanielYang59

  committed
  44fda8d

• remove duplicate from merging

  DanielYang59

  committed
  0f02418

Commits on Nov 20, 2024

• clean up comments

  DanielYang59

  committed
  687effa

• skip netcdf4 for python3.13 as 1.6.5 cannot be installed

  DanielYang59

  committed
  cb0adc9

• make wheel build quiet

  DanielYang59

  committed
  ccda40d

Commits on Nov 21, 2024

• test openff-toolkit

  DanielYang59

  committed
  0f9d2a1

• still cannot install openff-toolkit

  DanielYang59

  committed
  18175db

• clean up comment

  DanielYang59

  committed
  e3f69e5

Commits on Dec 11, 2024

• Merge branch 'master' into support-python313

  Show description for f2cebdf
  shyuep

  authored
  f2cebdf

Commits on Dec 12, 2024

• Merge branch 'master' into support-python313

  DanielYang59

  committed
  e7f9b28

• remove manual torch install

  DanielYang59

  committed
  cf318de

Commits on Dec 20, 2024

• fix python version pin

  DanielYang59

  committed
  54bbc6b

Commits on Dec 24, 2024

• Merge branch 'master' into support-python313

  DanielYang59

  authored
  b3ca5f2