v0.1.5

ExtXYZ v0.1.5

Diff since v0.1.4

Merged pull requests:

• New version: v0.1.4 (#14) (@jameskermode)
• Add support for molecular xyzs without Lattice key (#17) (@joegilkes)

v0.1.4

ExtXYZ v0.1.4

Diff since v0.1.3

Merged pull requests:

• New version: v0.1.3 (#11) (@jameskermode)
• Fix isapprox for dictionaries in testing (and highlight existing errors) (#12) (@jamesgardner1421)
• Fix testing and transpose bug (#13) (@jameskermode)

v0.1.3

ExtXYZ v0.1.3

Diff since v0.1.2

Merged pull requests:

• New version: v0.1.2 (#9) (@jameskermode)
• Fix column ordering when writing files with only positions and species (#10) (@jamesgardner1421)

v0.1.2

ExtXYZ v0.1.2

Diff since v0.1.1

Closed issues:

• Incorrect file to dict transformation with multiple atoms (#8)

Merged pull requests:

• New version: v0.1.1 (#7) (@jameskermode)

v0.1.1

ExtXYZ v0.1.1

Diff since v0.1.0

Closed issues:

• Related packages (#1)
• JuLIP Dependency (#3)

Merged pull requests:

• New version: v0.1.0 (#4) (@jameskermode)

v0.1.0

ExtXYZ v0.1.0

Merged pull requests:

• CompatHelper: add new compat entry for "JuLIP" at version "0.8" (#2) (@github-actions[bot])