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Extend DFT classification with libvdwxc

improvement/fixImprovement or fix of a previous featureImprovement or fix of a previous feature

ModelMethod

Status: Open.

#278 In nomad-coe/nomad-simulations;

· ndaelman-hu opened on Nov 6, 2025

Annotate functional dependencies of Sections

new featureNew feature or requestNew feature or request

Status: Open.

#277 In nomad-coe/nomad-simulations;

· ndaelman-hu opened on Nov 6, 2025

Add labels to identify pull request scope

Status: Open.

Feature

#274 In nomad-coe/nomad-simulations;

· JosePizarro3 opened on Nov 5, 2025

add semi-empirical quantum chemistry methods

ModelMethod

new featureNew feature or requestNew feature or request

Status: Open.

#273 In nomad-coe/nomad-simulations;

· EBB2675 opened on Nov 4, 2025

Canonical mapping for quantum numbers (ℓ,mℓ)

Status: Open.

#269 In nomad-coe/nomad-simulations;

· EBB2675 opened on Nov 3, 2025

add self interaction method class

Status: Open.

#268 In nomad-coe/nomad-simulations;

· EBB2675 opened on Oct 31, 2025

Dependency Inversion <code>ChemicalFormula</code>

improvement/fixImprovement or fix of a previous featureImprovement or fix of a previous feature

ModelSystem

technical

Status: Open.

#266 In nomad-coe/nomad-simulations;

· ndaelman-hu opened on Oct 27, 2025

Add CLI to regenerate LibXC registry

Status: Open.

#264 In nomad-coe/nomad-simulations;

· EBB2675 opened on Oct 7, 2025

ModelMethod naming consistency

Status: Open.

#262 In nomad-coe/nomad-simulations;

· JFRudzinski opened on Oct 6, 2025

Inherited quantites in BaseSimulation

Status: Open.

#252 In nomad-coe/nomad-simulations;

· kubanmar opened on Aug 21, 2025

Reassess practice of reassigning general ParticleStates

ModelSystem

Status: Open.

#248 In nomad-coe/nomad-simulations;

· JFRudzinski opened on Aug 21, 2025

· 

1.0.0

Move Wyckoff to positions

Status: Open.

#242 In nomad-coe/nomad-simulations;

· ndaelman-hu opened on Aug 19, 2025