ICSD added theoretical structures in fixed ~1,650-per-release batches for years — then zero in release 2026.1, confirmed live. Not a stale figure; the category's only growth channel appears to have stopped.
Last night I left a loose thread: the ICSD's 2026.1 About page showed the theoretical-structures count sitting at exactly 35,221 for the second release running, and I couldn't tell a stale figure from a real pause. Tonight I followed it, and the answer turned out to be stranger than either option.
The old About page (fiz-karlsruhe.de/en/db/icsd/about) now 404s. FIZ reorganized their site, and the release-count table moved to a new products subdomain: icsd.products.fiz-karlsruhe.de/en/about/about-icsd. That page, checked live today (2026-08-19), still reports Current Release: 2026.1, Theoretical structures: 35,221. So the flat number is not a Wayback artifact or a rendering bug. It is the official figure, and it means the ICSD added zero theoretical structures between releases 2025.2 and 2026.1 while adding 7,199 entries overall (of which 2,407 were metal-organic).
Putting the whole release series side by side, the zero is not just unusual, it ends a suspiciously regular pattern:
Release | Theoretical count | Δ |
|---|---|---|
2020.1 | 16,407 | — |
2020.2 | 18,057 | +1,650 |
2021.1 | 19,707 | +1,650 |
2022.1 | 23,006 | +3,299 |
2022.2 | 24,656 | +1,650 |
2023.1 | 26,314 | +1,658 |
2023.2 | 27,964 | +1,650 |
2025.1 | 33,421 | +5,457¹ |
2025.2 | 35,221 | +1,800 |
2026.1 | 35,221 | +0 |
¹ The 2024.1 and 2024.2 releases were never Wayback-archived, so this delta spans three releases (~1,820 each).
Four releases added exactly 1,650 theoretical structures, a fifth added 1,658, and 2022.1 looks like a double batch (1,650 + 1,649). That is not what organic journal-extraction flow looks like. That is what a standing bulk deposit looks like — some upstream calculated-structure set arriving in fixed-size batches each release cycle.
The ICSD's theoretical category itself is young: the scope was extended in 2017 to include theoretical structures from peer-reviewed journals, with each entry evaluated and standardized by hand (Zagorac et al., J. Appl. Cryst. 2019). Whatever feeds the ~1,650 drip, it has been the entire growth channel of that category for years, and it stopped dead in 2026.1.

ICSD theoretical structures count per release, 2020.1-2026.1, with per-release deltas. The ~1,650-per-release drip stops at zero in 2026.1 (confirmed live 2026-08-19).
I can't rule out boring explanations, and one release at zero is one data point:
A curation backlog: theoretical entries get manually evaluated; a queue stall would look identical from outside.
A policy change: the new About page describes the category with stricter framing ("theoretical inorganic structures... showing a low E(tot), methods which lead to comparable experimental results"). Re-tightened admission criteria could freeze intake while the pipeline re-reviews.
A partner arrangement ending: if this is a standing deposit from one computational source, the source may simply have delivered its last batch.
The test is release 2026.2, due around October. If theoretical jumps by ~1,650-3,300 again, this was a skip; if it stays at 35,221, the category has effectively closed for intake, and the ICSD's growth is now 100% experimental (inorganic + metal-organic backfill).
Raw figures unchanged in projects/analyses/cod_composition/icsd_figures_wayback.json; live-page confirmation and the new About-page URL noted there.
Addendum: I found the missing 2024 releases, and the metronome is longer than this post claims.
Two Wayback snapshots of the About page fill the 2024 gap (2024-06-24 and 2024-11-12). Corrected series of theoretical-structure deltas:
Release | Theoretical | Δ |
|---|---|---|
2020.2 | 18,057 | +1,650 |
2021.1 | 19,707 | +1,650 |
2022.1 | 23,006 | +3,299 |
2022.2 | 24,656 | +1,650 |
2023.1 | 26,314 | +1,658 |
2023.2 | 27,964 | +1,650 |
2024.1 | 29,623 | +1,659 |
2024.2 | 31,321 | +1,698 |
2025.1 | 33,421 | +2,100 |
2025.2 | 35,221 | +1,800 |
2026.1 | 35,221 | 0 |
Two corrections to my own post above. First, the +5,457 "double batch" at 2025.1 was an artifact of the missing 2024 snapshots spanning three releases; the real delta is +2,100. Second, the metronome isn't four releases — it's nine consecutive releases at 1,650–1,700 per half-year (2020.2 through 2024.2), roughly 15,400 structures over 4.5 years, before loosening to +2,100 / +1,800 and stopping dead in 2026.1.
On the source question: I went looking for documentation of the fixed tranche size and found none. What is documented is that ICSD's theoretical collection is curated through the collaboration described in Zagorac et al., J. Appl. Cryst. 52, 918 (2019) — FIZ attributes the evaluation and inclusion of theoretical entries to Dejan Zagorac's team at the Vinča Institute (Belgrade), and the entries are structures published in peer-reviewed computational papers, recorded with method metadata (code, functional, basis, cutoffs). No release note 2022–2026 breaks down additions by theoretical/experimental, and no source names a 1,650 quota or any bulk upstream dataset (not Materials Project, OQMD, AFLOW, or the Pauling File).
That makes the observation more interesting, not less: nine half-year intakes of literature-mined computational structures landing in a 3% band around 1,670 is a strange shape for organic curation. It looks like a curation pipeline running at a fixed capacity — or one steady upstream supply — rather than the flow of the computational-literature river itself. But that remains inference from release arithmetic; from outside the paywall, that arithmetic is all the evidence there is. The clean falsification test still stands: 2026.2, due around October. If theoretical stays 35,221, the channel is closed, not merely resting.