Our main interest is in the relationship between the structure and properties of solids. We study the geometric reasons for the chemical activity of solids and the relationship between local order and physical properties, using mathematical techniques and computer graphics. We use solid-state nuclear magnetic resonance spectroscopy (NMR) to examine molecular sieves, minerals, layered materials, fullerenes, ceramics and biological materials.

The G minimal surface divides space into two interpenetrating labyrinths (coloured red and green).

Specific projects:

  • Periodic minimal surfaces (surfaces with zero mean curvature), which appear in a variety of inorganic, organic and biological structures, and the associated mathematical problems.
  • Morphogenesis (the origin of shape and form).
  • Systematic enumeration of crystalline networks using mathematical tiling theory.
  • Graphite, graphite oxide and graphene.
  • Synthesis and characterization of microporous and mesoporous molecular sieves.
  • Synthesis and characterization of metal-organic frameworks (MOFs).

Selected Publications

Hypothetical zeolitic frameworks: In search of potential heterogeneous catalysts. J. Phys. Chem. 112, 1040 (2008)

Low-temperature thermal decomposition of large single crystals of ammonium perchlorate. Chem. Phys. Lett. 454, 233 (2008)

Simulating self-assembly of ZnS nanoparticles into mesoporous materials. J. Am. Chem. Soc. 128, 15283 (2006)

Cross-polarization in the solid state. A guide for chemists. Chem. Rev. 102, 613 (2002)

Synthesis and characterization of a new layered compound of trimesic acid. New Journal of Chemistry 26, 381 (2002)

Exact computation of the triply periodic G ('gyroid") minimal surface. Chem. Phys. Lett. 321, 363 (2000)

Systematic enumeration of crystalline networks. Nature 400, 644 (1999)

Structural studies of tabasheer, an opal of plant origin. Phil. Mag. A 77, 201 (1998)

Structure of graphite oxide revisited. J. Phys. Chem. B102, 4477 (1998)

Solid-state NMR studies of fullerene C60/benzene solvates. J. Phys. Chem. B101, 117 (1997)

New rapidly convergent series representations for z (2 n + 1). Proc. Am. Math. Soc. 125, 1263 (1997)

Directing the pore dimensions in the mesoporous molecular sieve MCM-41. Chem. Phys. Lett. 263, 247 (1996)

Taboo Search: an approach to the multiple-minima problem. Science, 267, 664 (1995)

Publications

ESCA, Solid-State NMR, and X-ray Diffraction Monitor the Hydrogen Bonding in a Complex of 1,8-Bis(dimethylamino)naphthalene with 1,2-Dichloromaleic Acid
K Wozniak, H He, J Klinowski, W Jones, TL Barr
Journal of Physical Chemistry
(2002)
99
Structural studies of pillared saponite
L Li, X Liu, Y Ge, R Xu, J Rocha, J Klinowski
The Journal of Physical Chemistry
(2002)
97
Solid-State NMR and ESCA Studies of the Framework Aluminosilicate Analcime and Its Gallosilicate Analog
H He, C-F Cheng, S Seal, TL Barr, J Klinowski
Journal of Physical Chemistry
(2002)
99
In situ 13C solid-state NMR studies of the catalytic conversion of methanol on expanded montmorillonites and saponites
H He, L Zhang, J Klinowski, ML Occelli
Journal of Physical Chemistry
(2002)
99
Spectroscopic studies of barium aluminate glycolate, Ba[Al2(C2H4O2)4], a 5-coordinate aluminum compound
B Herreros, TL Barr, J Klinowski
The Journal of Physical Chemistry
(2002)
98
H-1 MAGIC-ANGLE-SPINNING NMR-STUDIES OF THE ADSORPTION OF ALCOHOLS ON MOLECULAR-SIEVE CATALYSTS
MW Anderson, J Klinowski, PJ Barrie
Journal of Physical Chemistry
(2002)
95
SOLID-STATE MAGIC-ANGLE SPINNING AL-27 NUCLEAR MAGNETIC-RESONANCE STUDIES OF ZEOLITES USING A 400-MHZ HIGH-RESOLUTION SPECTROMETER
CA Fyfe, GC Gobbi, JS Hartman, J Klinowski, JM Thomas
Journal of Physical Chemistry
(2002)
86
ESCA studies of aluminophosphate molecular sieves
H He, K Alberti, TL Barr, J Klinowski
The Journal of Physical Chemistry
(2002)
97
Spectroscopic Studies of 5-Coordinate Silicon Compounds
B Herreros, TL Barr, PJ Barrie, J Klinowski
The Journal of Physical Chemistry
(2002)
98
Synthesis and structural characterization of the aluminophosphate molecular sieve DPA-VPI-5
X Liu, H He, J Klinowski
Journal of Physical Chemistry
(2002)
95

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