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Information card for entry 8000501
Preview
Coordinates | 8000501.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | TON_BNHx |
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Formula | C0.28 N1.68 O24 Si12 |
Calculated formula | C0.28 N1.68 O24 Si12 |
Title of publication | Anomalous Volume Changes in the Siliceous Zeolite Theta-1 TON due to Hydrogen Insertion under High-Pressure, High-Temperature Conditions. |
Authors of publication | Paliwoda, Damian; Comboni, Davide; Poręba, Tomasz; Hanfland, Michael; Alabarse, Frederico; Maurin, David; Michel, Thierry; Demirci, Umit B.; Rouquette, Jérôme; di Renzo, Francesco; van der Lee, Arie; Bernard, Samuel; Haines, Julien |
Journal of publication | The journal of physical chemistry letters |
Year of publication | 2021 |
Journal volume | 12 |
Journal issue | 21 |
Pages of publication | 5059 - 5063 |
a | 13.826 ± 0.002 Å |
b | 17.372 ± 0.005 Å |
c | 5.0259 ± 0.001 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 1207.1 ± 0.5 Å3 |
Cell temperature | 293 K |
Ambient diffraction temperature | 293 K |
Number of distinct elements | 4 |
Space group number | 36 |
Hermann-Mauguin space group symbol | C m c 21 |
Hall space group symbol | C 2c -2 |
Residual factor R(I) for significantly intense reflections | 2.7412 |
Method of determination | powder diffraction |
Diffraction radiation wavelength | 0.4957 Å |
Diffraction radiation type | synchrotron |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
265766 (current) | 2021-06-04 | cif/ Updating files of 8000501 Original log message: Adding full bibliography for 8000501.cif. |
8000501.cif |
265459 | 2021-05-23 | cif/ Adding structures of 8000501 via cif-deposit CGI script. |
8000501.cif |
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