Matscipy

- Calculator for Manybody potentials e.g. Stillinger-Weber and Bond-order
- Specific parametrizations for Tersoff-Brenner potentials, Stillinger-Weber and Kumagai
- Analytic computation of Hessian matrix for manybody potentials
- Analytic computation of zero-temperature elastic constants for pair potential and manybody potentials
- CLI for electrochemistry functions
- Proper molecular id numbering in electrochemistry
- Generation of dislocations

- Numerical computation of the Hessian matrix
- Calculator for polydisperse systems in which particles interact via a pair potential
- Analytic computation of Hessian for polydisperse systems
- Bug fix in tests eam_calculator_forces_hessian

- Enabling automatic publishing on PyPI

- Enabling automatic publishing on PyPI

- Sinclair flexible boundary conditions for cracks and arc-length continuation
- Bug fix in neighbour list search that lead to occasional segfaults