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Development plan

Current status (implemented in the 0.1.x line)

  • stable element metadata
  • curated covalent, van der Waals, and atomic-radius support datasets
  • explicit provenance and coverage metadata
  • generic value-policy core plus radii and X–H convenience wrappers
  • substitution and linear transfer
  • custom element-indexed scalar sets
  • policy-backed transfer sources
  • nested-policy safeguards, transfer-depth tracking, and cycle detection
  • provisional X–H support via csd_legacy_xh_cno, XHPolicy, and DEFAULT_XH_POLICY

Planned for 0.2.x

  • broader X–H datasets and policies
  • experimental plus computational support sets
  • pairwise helper logic such as reference sums and normalization schemes
  • restoration of incomplete experimental data from broader-support predictors

Longer-term design ideas

  • radial atomic reference functions
  • simple proto-density support based on spherically averaged atomic data

Possible future directions

  • more radii sets
  • uncertainty and confidence flags
  • ion-specific or atom-type-specific domains
  • density-derived radii and related reference transforms