v0.4.0

GaussianBasis v0.4.0

Diff since v0.3.0

Closed issues:

• Simpler integral calls for shell pairs (#6)
• Periodic boundary conditions? (#7)

Merged pull requests:

• update Project.toml (#9) (@hfmull)
• Fundamental changes to GaussianBasis: working with different backends (#10) (@gustavojra)
• New version. New README (#11) (@gustavojra)
• Preparing GaussianBasis for future AD uses (#13) (@hfmull)

v0.3.0

GaussianBasis v0.3.0

Diff since v0.2.1

Merged pull requests:

• Spherical and Cartesian basis (#8) (@gustavojra)

v0.2.1

GaussianBasis v0.2.1

Diff since v0.2.0

v0.2.0

GaussianBasis v0.2.0

Diff since v0.1.1

Closed issues:

• libcint: use Julia Artifact libcint_jll.jl (#3)
• Drop deps/build.jl (#4)

Merged pull requests:

• Use libcint_jll instead of deps/build.jl solution (#3) (#5) (@carstenbauer)

v0.1.1

GaussianBasis v0.1.1

Diff since v0.1.0

v0.1.0

GaussianBasis v0.1.0