feature/SOF-8044 Feature: add the h-BN boron-vacancy formation-energy tutorial page - #404

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feature/SOF-8044

Commits on Sep 13, 2026

docs: add simulation tutorial for h-BN boron-vacancy formation energy

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934b63f
docs: fix formation-energy sign, reference-model claim, add Guide nav

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168c8ce
docs: correct pseudopotential family to GBRV ultrasoft

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b4ff51b
docs: fix Bertoldo2022 journal, reuse claims and cutoff comparability

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7ba995d
docs: sync reuse/cluster/verdict claims with api-examples 64b562aa

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6dc8ddf
docs: describe both CLUSTER_NAME branches (unset vs not found)

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d23ba22
docs: name the combined notebook, fix verdict string, expand acronyms

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7c69226
docs: match the manuscript's QPOD expansion, expand GBRV, fix section ref

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0820dbd

Commits on Sep 15, 2026

docs: report the doublet run and the quartet/doublet spin split

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51b5fb7
docs: fix contradictory relaxation claim, report the doublet run's own timing

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7c2c28e

Commits on Sep 16, 2026

docs: add the optional relaxation, tighten tolerance to 0.2 eV

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5a99bd1
docs: reconcile the printed force with the convergence criterion

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b24e9f0
docs: drop the reference-mismatch verdict suffix and warning

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3f17878
docs: link the Bertoldo row to the new formation-energy page

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b0a286a
docs: rewrite the page to match the sibling tutorials' shape

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579e1fa
docs: rewrite to the merged siblings' section shape, not SOF-8043's

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97fef41