Natural tilings and free space in zeolites: models, statistics, correlations, prediction

References

[1] Zeolite framework database; http://www.iza-structure.org/.Search in Google Scholar

[2] M. M. J. Treacy, I. Rivin, E. Balkovsky, K. H. Randall, M. D. Foster, Enumeration of periodic tetrahedral frameworks. II. Polynodal graphs. Micropor. Mesopor. Mater.2004, 74, 121.10.1016/j.micromeso.2004.06.013Search in Google Scholar

[3] R. Pophale, P. A. Cheeseman, M. W. Deem, A database of new zeolite-like materials. Phys. Chem. Chem. Phys.2011, 13, 12407.10.1039/c0cp02255aSearch in Google Scholar PubMed

[4] Y. Li, J. Yu, R. Xu, Criteria for zeolite frameworks realizable for target synthesis. Angew. Chem. Int. Ed.2013, 52, 1673.10.1002/anie.201206340Search in Google Scholar PubMed

[5] R. M. Barrer, J. W. Baynham, F. W. Bultitude, W. M. Meier, Hydrothermal chemistry of the silicates. Part VIII. Low-temperature crystal growth of aluminosilicates, and of some gallium and germanium analogues. J. Chem. Soc.1959, 0, 195.10.1039/jr9590000195Search in Google Scholar

[6] W. M. Meier, Molecular Sieves. Society of Chem. and Industry, London, 1968.Search in Google Scholar

[7] D. W. Breck, Zeolite Molecular Sieves. Wiley, New York, 1974.Search in Google Scholar

[8] J. V. Smith, Microporous and other Framework Materials with Zeolite-Type Structures; Landolt-Börnstein New Series IV/14 Subvolume A: Tetrahedral Frameworks of Zeolites, Clathrates and Related Materials; Springer, Berlin 2000.Search in Google Scholar

[9] H. Van Königsveld, Compendium of Zeolite Framework Types. Elsevier, London, 2007.Search in Google Scholar

[10] R. X. Fischer, W. H. Baur, Microporous and other Framework Materials with Zeolite-Type Structures; Landolt-Börnstein – Group IV Physical Chemistry (Numerical Data and Functional Relationships in Science and Technology), vols. 14B-14H. Springer, Berlin, Heidelberg, 2000, 2002, 2006, 2009, 2013, 2015, 2017.Search in Google Scholar

[11] V. A. Blatov, G. D. Ilyushin, D. M. Proserpio, The zeolite conundrum: why are there so many hypothetical zeolites and so few observed? A possible answer from the zeolite-type frameworks perceived as packings of tiles. Chem. Mater.2013, 25, 412.10.1021/cm303528uSearch in Google Scholar

[12] V. A. Blatov, O. Delgado-Friedrichs, M. O’Keeffe, D. M. Proserpio, Three-periodic nets and tilings: natural tilings for nets. Acta Cryst.2007, A63, 418.10.1107/S0108767307038287Search in Google Scholar PubMed

[13] M. Anderson, J. Gebbie, A. Hill, N. Farida, M. Attfield, P. Cubillas, V. A. Blatov, D. M. Proserpio, D. Akporiaye, B. Arstad, J. Gale, Predicting crystal growth via a unified kinetic three-dimensional partition model. Nature2017, 544, 456.10.1038/nature21684Search in Google Scholar PubMed

[14] N. A. Anurova, V. A. Blatov, G. D. Ilyushin, D. M. Proserpio, Natural Tilings for Zeolite-Type Frameworks. J. Phys. Chem. C2010, 114, 10160.10.1021/jp1030027Search in Google Scholar

[15] V. A. Blatov, A. P. Shevchenko, Analysis of voids in crystal structures: the methods of ‘dual’ crystal chemistry. Acta Cryst.2003, A59, 34.10.1107/S0108767302020603Search in Google Scholar

[16] O. Delgado Friedrichs, M. O’Keeffe, O. M. Yaghi, Three-periodic nets and tilings: regular and quasiregular nets. Acta Cryst.2003, A59, 22.10.1107/S0108767302018494Search in Google Scholar PubMed

[17] V. A. Blatov, A. P. Shevchenko, D. M. Proserpio, Applied topological analysis of crystal structures with the program package ToposPro. Cryst. Growth Des.2014, 14, 3576.10.1021/cg500498kSearch in Google Scholar

[18] N. W. Ockwig, O. Delgado-Friedrichs, M. O’Keeffe, O. M. Yaghi, Reticular chemistry: occurrence and taxonomy of nets and grammar for the design of frameworks. Acc. Chem. Res.2005, 38, 176.10.1021/ar020022lSearch in Google Scholar PubMed

[19] E. D. Kuznetsova, O. A. Blatova, V. A. Blatov, Predicting new zeolites: a combination of thermodynamic and kinetic factors. Chem. Mater.2018, 30, 2829.10.1021/acs.chemmater.8b00905Search in Google Scholar

[20] C. J. Dawson, V. Kapko, M. F. Thorpe, M. D. Foster, M. M. J. Treacy, Flexibility as an indicator of feasibility of zeolite frameworks. J. Phys. Chem. C2012, 116, 16175.10.1021/jp2107473Search in Google Scholar

[21] M. O’Keeffe, M. A. Peskov, S. J. Ramsden, O. M. Yaghi, The reticular chemistry structure resource (RCSR) database of, and symbols for, crystal nets. Acc. Chem. Res.2008, 41, 1782.10.1021/ar800124uSearch in Google Scholar PubMed

[22] F. Aman, A. M. Asiri, W. A. Siddiqui, M. N. Arshad, A. Ashraf, N. S. Zakharov, V. A. Blatov, Multilevel topological description of molecular packings in 1,2-benzothiazines. CrystEngComm. 2014, 16, 1963.10.1039/C3CE42218FSearch in Google Scholar

[23] E. Koch, W. Fischer, Types of sphere packings for crystallographic point groups, rod groups and layer groups. Z. Kristallogr.1978, 148, 107.10.1524/zkri.1978.148.1-2.107Search in Google Scholar

[24] A. Turrina, R. Garcia, A. E. Watts, H. F. Greer, J. Bradley, W. W. Zhou, P. A. Cox, M. D. Shannon, A. Mayoral, J. L. Casci, P. A. Wright, STA-20: an ABC-6 zeotype structure prepared by co-templating and solved via a hypothetical structure database and STEM-ADF imaging. Chem. Mater.2017, 29, 2180.10.1021/acs.chemmater.6b04892Search in Google Scholar

[25] D. Xie, L. B. McCusker, C. Baerlocher, S. I. Zones, W. Wan, X. Zou, SSZ-52, a zeolite with an 18-layer aluminosilicate framework structure related to that of the deNOx catalyst Cu-SSZ-13. J. Am. Chem. Soc.2013, 135, 10519.10.1021/ja4043615Search in Google Scholar PubMed

[26] V. A. Blatov, G. D. Ilyushin, A. E. Lapshin, O. Y. Golubeva, Structure and chemical composition of the new zeolite ISC-1 from the data of nanocluster modeling. Glass Phys. Chem.2010, 36, 663.10.1134/S1087659610060040Search in Google Scholar

[27] H. Lee, J. Shin, W. Choi, H. J. Choi, T. Yang, X. Zou, S. B. Hong, PST-29: a missing member of the RHO family of embedded isoreticular zeolites. Chem. Mater.2018, 30, 6619.10.1021/acs.chemmater.8b03311Search in Google Scholar

[28] V. A. Blatov, Voronoi-Dirichlet polyhedra in crystal chemistry: theory and applications. Cryst. Rev.2004, 10, 249.10.1080/08893110412331323170Search in Google Scholar

[29] T. F. Willems, C. H. Rycroft, M. Kazi, J. C. Meza, M. Haranczyk, Algorithms and tools for high-throughput geometry-based analysis of crystalline porous materials. Microp. Mesop. Mater.2012, 149, 134.10.1016/j.micromeso.2011.08.020Search in Google Scholar

[30] M. V. Peskov, V. A. Blatov, G. D. Ilyushin, U. Schwingenschlögl, Computer-aided modeling of aluminophosphate zeolites as packings of building units. J. Phys. Chem C2012, 116, 6734.10.1021/jp2115252Search in Google Scholar