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      Synthesis of 'unfeasible' zeolites.

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          Abstract

          Zeolites are porous aluminosilicate materials that have found applications in many different technologies. However, although simulations suggest that there are millions of possible zeolite topologies, only a little over 200 zeolite frameworks of all compositions are currently known, of which about 50 are pure silica materials. This is known as the zeolite conundrum--why have so few of all the possible structures been made? Several criteria have been formulated to explain why most zeolites are unfeasible synthesis targets. Here we demonstrate the synthesis of two such 'unfeasible' zeolites, IPC-9 and IPC-10, through the assembly-disassembly-organization-reassembly mechanism. These new high-silica zeolites have rare characteristics, such as windows that comprise odd-membered rings. Their synthesis opens up the possibility of preparing other zeolites that have not been accessible by traditional solvothermal synthetic methods. We envisage that these findings may lead to a step change in the number and types of zeolites available for future applications.

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          Most cited references21

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          The hydrothermal synthesis of zeolites: history and development from the earliest days to the present time.

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            Interatomic potentials for SiO2

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              A database of new zeolite-like materials.

              We here describe a database of computationally predicted zeolite-like materials. These crystals were discovered by a Monte Carlo search for zeolite-like materials. Positions of Si atoms as well as unit cell, space group, density, and number of crystallographically unique atoms were explored in the construction of this database. The database contains over 2.6 M unique structures. Roughly 15% of these are within +30 kJ mol(-1) Si of α-quartz, the band in which most of the known zeolites lie. These structures have topological, geometrical, and diffraction characteristics that are similar to those of known zeolites. The database is the result of refinement by two interatomic potentials that both satisfy the Pauli exclusion principle. The database has been deposited in the publicly available PCOD database and in www.hypotheticalzeolites.net/database/deem/.
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                Author and article information

                Journal
                Nat Chem
                Nature chemistry
                Springer Nature
                1755-4349
                1755-4330
                Jan 2016
                : 8
                : 1
                Affiliations
                [1 ] J. Heyrovský Institute of Physical Chemistry, Academy of Sciences of the Czech Republic, v.v.i., Dolejškova 3, 182 23 Prague 8, Czech Republic.
                [2 ] EaStCHEM School of Chemistry, University of St Andrews, St Andrews KY16 9ST, UK.
                [3 ] Department of Physical and Macromolecular Chemistry, Faculty of Science, Charles University in Prague, Hlavova 8, 128 43 Prague 2, Czech Republic.
                [4 ] Advanced Microscopy Laboratory (LMA), Nanoscience Institute of Aragon (INA), University of Zaragoza, Mariano Esquillor, Edificio I+D, Zaragoza 50018, Spain.
                Article
                nchem.2374
                10.1038/nchem.2374
                26673264
                110c8f0e-8096-47b3-84c7-7e9e25cb7e0c
                History

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