Crystal structure of new synthetic calcium pentaborate Ca[B5O8(OH)] · H2O and its relation to pentaborates with similar boron-oxygen radicals
Bibliographic record
Abstract
A new representative of pentaborates with the composition Ca[B5O8(OH)] · H2O was synthesized under hydrothermal conditions within the framework of the study of phase formation in the CaCl2-Na2CO3-B2O3 system. The crystal structure of the new pentaborate was established (a = 6.5303(9) Å, b = 19.613(3) Å, c = 6.5303(9) Å, β = 119.207(2)°, V = 2513(2) Å3, sp. gr. P21/c, Z = 4, d calcd = 2.74 g/cm3, automated Brucker SMART CCD diffractometer, 6871 reflections, λMo radiation, anisotropic refinement by least-squares, R hkl = 0.076). The structure of calcium pentaborate is built by isolated B-Ca-B stacks parallel to the (010) plane. The central fragments of these stacks consists of nine-vertex Ca polyhedra. The Ca layers are located between loose B-O networks composed of [B 2 t B 3 Δ O8(OH)]2− pentaborate groups. The arrangement of the polyhedra around large cations in pentaborates with groups of two B tetrahedra and three B triangles was analyzed in terms of crystal chemistry. It is established that the structures of these compounds consist of large isolated polyhedra, columns, layers, and three-dimensional frameworks.
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How this classification was reachedexpand
Full frame machine prediction
Teacher imitationNot calibrated prevalence, not ground truth. Human validation pending. The Gemma side is a direct model label for every work in the frame, read from the title-only record. The Codex side is a classifier learned from the 10,348 direct Codex labels and calibrated to design-weighted sample rates; fields without enough sample support carry no Codex call. Candidate is the union of the two sides; consensus is their intersection. These outputs are machine_predicted_unvalidated and are not human labels.
Distilled classifier scores by category (both heads)
| Category | Codex | Gemma |
|---|---|---|
| Metaresearch | 0.000 | 0.000 |
| Meta-epidemiology (narrow) | 0.000 | 0.000 |
| Meta-epidemiology (broad) | 0.000 | 0.000 |
| Bibliometrics | 0.000 | 0.000 |
| Science and technology studies | 0.000 | 0.000 |
| Scholarly communication | 0.000 | 0.000 |
| Open science | 0.000 | 0.000 |
| Research integrity | 0.000 | 0.000 |
| Insufficient payload (model declined to judge) | 0.001 | 0.000 |
Machine scores (provisional)
The two teacher heads of the student model, read on this work. A score orders the frame for review; it never asserts a category, and the validation status ships verbatim with every row.
Baseline scores from an immature model (maturity gate not passed, 7 training rounds). Scores rank; they never assert a category.
score_only:v0-immature-baseline · verbatim from the scoring run: score_only means the number may rank works, and no category label ships from itClassification
machine, unvalidatedMachine predicted; a candidate call from one source (direct Gemma or distilled Codex), not a consensus.
How this classification was reached, model by model and score by score, is at the end of the page under "How this classification was reached".