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Add linear algebra solver architecture with a Preconditioned Conjugate Gradient solver - #77

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timchem1508 wants to merge 4 commits into

grimme-lab:mainfrom

timchem1508:solver

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Add linear algebra solver architecture with a Preconditioned Conjugate Gradient solver#77
timchem1508 wants to merge 4 commits into
grimme-lab:mainfrom
timchem1508:solver

Commits on Oct 27, 2026
- Add linear algebra solver architecture
  timchem1508
  committed
  9b8a303
- FIX: increase the meson test timeout up to 120; Windows DLL link.
  timchem1508
  committed
  939f541
Commits on Oct 28, 2026
- remove timers from the solver tests; fix the alphabetical order in the meson amd cmake files; use the upstream thresholds in the pbc tests.
  timchem1508
  committed
  87f1e33
- FIX: Energy symv call (model/type.F90:401) now passes cache%vrhs(:ndim), cache%xvec(:ndim). Refactor solver input handling; replace solver_maker with new_mchrg_solver in tests
  timchem1508
  committed
  22fd268