Computational Discovery of New Zeolite-Like Materials

Single-crystal structure validation with the program PLATON

Spek, A. L. (2003) · Journal of Applied Crystallography · doi:10.1107/s0021889802022112 · Cited by 14,113 · see citing works

Ordered porous materials for emerging applications

Davis, M. E. (2002) · Nature · doi:10.1038/nature00785 · Cited by 5,308 · see citing works

Atlas of Zeolite Framework Types

(2007) · Elsevier eBooks · doi:10.1016/b978-0-444-53064-6.x5186-x · Cited by 2,539 · see citing works

The Reticular Chemistry Structure Resource (RCSR) Database of, and Symbols for, Crystal Nets

O’Keeffe, M., Peskov, M. V., Ramsden, S. J., & Yaghi, O. M. (2008) · Accounts of Chemical Research · doi:10.1021/ar800124u · Cited by 2,316 · see citing works

The General Utility Lattice Program ( <scp>GULP</scp> )

Gale, J. D., & Rohl, A. L. (2003) · Molecular Simulation · doi:10.1080/0892702031000104887 · Cited by 2,265 · see citing works

Force fields for silicas and aluminophosphates based on ab initio calculations

van Beest, B. W. H., Kramer, G. J., & van Santen, R. A. (1990) · Physical Review Letters · doi:10.1103/physrevlett.64.1955 · Cited by 1,519 · see citing works

Atlas of Zeolite Framework Types

(2001) · Elsevier eBooks · doi:10.1016/b978-0-444-50701-3.x5000-9 · Cited by 844 · see citing works

Towards a molecular understanding of shape selectivity

Smit, B., & Maesen, T. L. M. (2008) · Nature · doi:10.1038/nature06552 · Cited by 592 · see citing works

High-throughput synthesis and catalytic properties of a molecular sieve with 18- and 10-member rings

Corma, A., Díaz-Cabañas, M. J., Jordá, J. L., Martı́nez, C., & Moliner, M. (2006) · Nature · doi:10.1038/nature05238 · Cited by 510 · see citing works

Bridging hydrodyl groups in zeolitic catalysts: a computer simulation of their structure, vibrational properties and acidity in protonated faujasites (HY zeolites)

Schröder, K.-P., Sauer, J., Leslie, M., Catlow, C. R. A., Catlow, C. R. A., & Thomas, J. M. (1992) · Chemical Physics Letters · doi:10.1016/0009-2614(92)90030-q · Cited by 394 · see citing works

A biased Monte Carlo scheme for zeolite structure solution

Falcioni, M., & Deem, M. W. (1999) · The Journal of Chemical Physics · doi:10.1063/1.477812 · Cited by 315 · see citing works

De novo design of structure-directing agents for the synthesis of microporous solids

Lewis, D. W., Willock, D. J., Catlow, C. R. A., et al. (1996) · Nature · doi:10.1038/382604a0 · Cited by 313 · see citing works

A biased Monte Carlo scheme for zeolite structure solutionPreprint

Falcioni, M., & Deem, M. W. (1999) · Cited by 272 · see citing works

Enumeration of periodic tetrahedral frameworks. II. Polynodal graphs

Treacy, M. M. J., Rivin, I., Balkovsky, E., Randall, K. H., & Foster, M. D. (2004) · Microporous and Mesoporous Materials · doi:10.1016/j.micromeso.2004.06.013 · Cited by 203 · see citing works

Toward a Database of Hypothetical Zeolite Structures

Earl, D. J., & Deem, M. W. (2006) · Industrial & Engineering Chemistry Research · doi:10.1021/ie0510728 · Cited by 177 · see citing works

Determination of 4-connected framework crystal structures by simulated annealing

Deem, M. W., & Newsam, J. M. (1989) · Nature · doi:10.1038/342260a0 · Cited by 157 · see citing works

Mechanical and Dielectric Properties of Pure‐Silica‐Zeolite Low‐k Materials

Li, Z., Johnson, M. C., Sun, M., Ryan, E. T., Earl, D. J., Maichen, W., Martin, J. I., Li, S., Lew, C. M., Wang, J., et al. (2006) · Angewandte Chemie International Edition · doi:10.1002/anie.200602036 · Cited by 146 · see citing works

Framework crystal structure solution by simulated annealing: test application to known zeolite structures

Deem, M. W., & Newsam, J. M. (1992) · Journal of the American Chemical Society · doi:10.1021/ja00044a035 · Cited by 142 · see citing works

Chemically feasible hypothetical crystalline networks

Foster, M. D., Simperler, A., Bell, R. G., Friedrichs, O. D., Paz, F. A. A., & Klinowski, J. (2004) · Nature Materials · doi:10.1038/nmat1090 · Cited by 139 · see citing works

The chemistry of phase selectivity in the synthesis of high-silica zeolites

Burton, A. W., Zones, S. I., & Elomari, S. (2005) · Current Opinion in Colloid & Interface Science · doi:10.1016/j.cocis.2005.08.005 · Cited by 128 · see citing works

Synthesis of Porous Materials: Zeolites: Clays, and Nanostructures

Occelli, M. L., & Kessler, H. (1996) · Medical Entomology and Zoology · Cited by 123 · see citing works

Phase selectivity in the syntheses of cage-based zeolite structures: An investigation of thermodynamic interactions between zeolite hosts and structure directing agents by molecular modeling

Burton, A. W., Lee, G. S., & Zones, S. I. (2006) · Microporous and Mesoporous Materials · doi:10.1016/j.micromeso.2005.11.022 · Cited by 105 · see citing works

Inorganic structure prediction withGRINSP

Bail, A. L. (2005) · Journal of Applied Crystallography · doi:10.1107/s0021889805002384 · Cited by 88 · see citing works

Monte Carlo study of the nucleation process during zeolite synthesis

Wu, M. G., & Deem, M. W. (2002) · The Journal of Chemical Physics · doi:10.1063/1.1430742 · Cited by 49 · see citing works

Hypothetical Zeolitic Frameworks: In Search of Potential Heterogeneous Catalysts

Majda, D., Paz, F. A. A., Friedrichs, O. D., et al. (2008) · The Journal of Physical Chemistry C · doi:10.1021/jp0760354 · Cited by 48 · see citing works

2D hyperbolic groups induce three-periodic Euclidean reticulations

Robins, V., Ramsden, S. J., & Hyde, S. T. (2004) · The European Physical Journal B · doi:10.1140/epjb/e2004-00202-2 · Cited by 33 · see citing works

A Statistical Mechanics Study of Ring Size, Ring Shape, and the Relation to Pores Found in Zeolites

Curtis, R., & Deem, M. W. (2003) · The Journal of Physical Chemistry B · doi:10.1021/jp027447+ · Cited by 29 · see citing works

On the Performance of DFT and Interatomic Potentials in Predicting the Energetics of (Three-Membered Ring-Containing) Siliceous Materials

Zwijnenburg, M. A., Corà, F., & Bell, R. G. (2007) · The Journal of Physical Chemistry B · doi:10.1021/jp071060v · Cited by 26 · see citing works

An efficient method for determining zeolite vertex symbols

Treacy, M. M. J., Foster, M. D., & Randall, K. H. (2005) · Microporous and Mesoporous Materials · doi:10.1016/j.micromeso.2005.08.024 · Cited by 24 · see citing works

Design for sieving

Davis, M. E. (1996) · Nature · doi:10.1038/382583a0 · Cited by 21 · see citing works

Frontiers between crystal structure prediction and determination by powder diffractometry

Bail, A. L. (2008) · Powder Diffraction · doi:10.1154/1.2903488 · Cited by 11 · see citing works

ChemInform Abstract: A Perspective on Zeolite Synthesis: How do You Know what You′ll Get?

Davis, M. E., & Zones, S. I. (1995) · ChemInform · doi:10.1002/chin.199541278 · Cited by 4 · see citing works

Computational Discovery of Transition-metal Complexes: From High-throughput Screening to Machine Learning

Nandy, A., Duan, C., Taylor, M. G., Liu, F., Steeves, A. H., & Kulik, H. J. (2021) · Chemical Reviews · doi:10.1021/acs.chemrev.1c00347 · Cited by 358 · see citing works

Evaluating topologically diverse metal–organic frameworks for cryo-adsorbed hydrogen storage

Gómez-Gualdrón, D. A., Colón, Y. J., Zhang, X., Wang, T. C., Chen, Y.-S., Hupp, J. T., Yildirim, T., Farha, O. K., Zhang, J., & Snurr, R. Q. (2016) · Energy &amp; Environmental Science · doi:10.1039/c6ee02104b · Cited by 332 · see citing works

<i>In silico</i> Design of Porous Polymer Networks: High-Throughput Screening for Methane Storage Materials

Martin, R. L., Simon, C. M., Smit, B., & Haranczyk, M. (2014) · Journal of the American Chemical Society · doi:10.1021/ja4123939 · Cited by 170 · see citing works

Machine Learning for the Discovery, Design, and Engineering of Materials.

Duan, C., Nandy, A., & Kulik, H. J. (2022) · Annual Review of Chemical and Biomolecular Engineering · doi:10.1146/annurev-chembioeng-092320-120230 · Cited by 69 · see citing works

Pressure-induced chemistry for the 2D to 3D transformation of zeolites

Mazur, M., Arévalo-López, A. M., Wheatley, P. S., Bignami, G. P. M., Ashbrook, S. E., Morales-García, Á., Nachtigall, P., Attfield, J. P., Čejka, J., & Morris, R. E. (2018) · Journal of Materials Chemistry A · doi:10.1039/c7ta09248b · Cited by 23 · see citing works

쳔연 Zeolite ( 제올라이트 ) 를 이용한 중금속 흡착제의 개발

김성수, 박만, 허남호, et al. (1991)

Polysulfone으로 제올라이트 A를 고정화한 방사성 물질제거용 PS-zeolite 비드 제조

이창한, 박정민, 감상규, et al. (2015)

Fast and efficient synthesis of SSZ-13 by interzeolite conversion of Zeolite Beta and Zeolite L

Tang, L., Haw, K., Zhang, Y., Fang, Q., Qiu, S., & Valtchev, V. (2019) · Microporous and Mesoporous Materials · doi:10.1016/j.micromeso.2019.02.021 · Cited by 65 · see citing works

Research Progress of zeolite synthesis from kaolin

Lin, W. Y. (2010) · Huagong jinzhan · Cited by 2 · see citing works

Estimation of activation energy for desorption of low-volatility dioxins on zeolites by TPD technique

Xi, H., Li, Z., Zhang, H., et al. (2003) · Separation and Purification Technology · doi:10.1016/s1383-5866(02)00150-8 · Cited by 48 · see citing works