Search results

add mace-polar

enhancementNew/improved feature or requestNew/improved feature or request

Status: Open.

#682 In stfc/janus-core;

· alinelena opened on Mar 6, 2026

Investigate NEB changes

bugSomething isn't workingSomething isn't working

testingUnit testing or CIUnit testing or CI

Status: Open.

#681 In stfc/janus-core;

· ElliottKasoar opened on Mar 6, 2026

Windows CI error from DPA3

bugSomething isn't workingSomething isn't working

testingUnit testing or CIUnit testing or CI

Status: Open.

#675 In stfc/janus-core;

· ElliottKasoar opened on Mar 4, 2026

Custom (Arch/Calculator dependent) properties in written structures (traj etc.)

enhancementNew/improved feature or requestNew/improved feature or request

Status: Open.

#673 In stfc/janus-core;

· harveydevereux opened on Feb 27, 2026

Unexpected restart behaviour when restart files are copied

bugSomething isn't workingSomething isn't working

Status: Open.

#668 In stfc/janus-core;

· trdurrant opened on Feb 19, 2026

Initial velocities for MD non-restart simulations

questionFurther information is requestedFurther information is requested

Status: Open.

#666 In stfc/janus-core;

· trdurrant opened on Feb 11, 2026

Training and fine-tuning tutorial

documentationImprovements or additions to documentationImprovements or additions to documentation

Status: Open.

#645 In stfc/janus-core;

· harveydevereux opened on Dec 11, 2025

·  

Requirements for paper release

final rdfs should be usable

enhancementNew/improved feature or requestNew/improved feature or request

Status: Open.

Feature

#630 In stfc/janus-core;

· alinelena opened on Nov 15, 2025

Dispersion without PBC

bugSomething isn't workingSomething isn't working

good first issueGood for newcomersGood for newcomers

Status: Open.

#625 In stfc/janus-core;

· trdurrant opened on Nov 3, 2025

-dev tests fail

bugSomething isn't workingSomething isn't working

Status: Open.

#618 In stfc/janus-core;

· alinelena opened on Oct 2, 2025

Add warning for geomopt pressure with no cell optimisation

enhancementNew/improved feature or requestNew/improved feature or request

Status: Open.

#609 In stfc/janus-core;

· ElliottKasoar opened on Sep 22, 2025

Add NEP

dependenciesUpgrades or fixes to dependenciesUpgrades or fixes to dependencies

Status: Open.

#593 In stfc/janus-core;

· ElliottKasoar opened on Aug 29, 2025