Skip to content

Releases: ejmeitz/SimpleCrystals.jl

v0.1.7

12 Oct 16:07
ab53564
Compare
Choose a tag to compare

Replaced SVector in Atom constructor with normal vector to enable modifications to atom positions once system is constructed.

v0.1.6

21 Jul 15:03
Compare
Choose a tag to compare

Fix bounding_box format to match AtomsBase API.

v0.1.5

15 Jul 01:40
71fa487
Compare
Choose a tag to compare

Added Atom constructors that accept an atomic_mass in place of an atomic symbol. This enables better control of the units and using masses not found in PeriodicTable.jl.

All pre-defined crystal structures (e.g. FCC) have new constructors that match this pattern.

v0.1.4

05 Jun 13:26
f308570
Compare
Choose a tag to compare

Fixed some issues in the Atom interface with displaying Atom object as ASCII.

v0.1.3

06 May 23:53
Compare
Choose a tag to compare

Changed some names in interface to differentiate between BravaisLattice's and Crystal's with the same name (e.g. CubicLattice vs. Cubic). Added a few more tests.

v0.1.2

04 May 01:23
Compare
Choose a tag to compare

AtomsBase support is complete, tables in docs fixed. API should not need major changes beyond bugs fixes at this point (unless goals change). More comprehensive docs might be written to aid use in Molly.

v0.1.1

27 Apr 01:35
Compare
Choose a tag to compare

Fixing issue with Registrator. Nothing new here.

v0.1.0

26 Apr 23:32
Compare
Choose a tag to compare

Frist release of SimpleCrystals, AtomsBase API not fully implemented yet but support for all 2D and 3D Bravais lattices is present.