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

Systematic enumeration of crystalline networks
OD Friedrichs, AWM Dress, DH Huson, J Klinowski, AL Mackay
Nature
(1999)
400
NMR and ESCA studies of the "silica garden" Bronsted acid catalyst
C Collins, G Mann, E Hoppe, T Duggal, TL Barr, J Klinowski
Physical Chemistry Chemical Physics
(1999)
1
Solid-state NMR studies of alkali metal ion complexes of p-tertbutyl-calixarenes
F Benevelli, W Kolodziejski, K Wozniak, J Klinowski
Chemical Physics Letters
(1999)
308
Integrals involving complete elliptic integrals
D Cvijovic, J Klinowski
Journal of Computational and Applied Mathematics
(1999)
106
A unique structure of Cu2(OH)3·NH3 crystals in the `silica garden' and their degradation under electron beam irradiation
C Collins, W Zhou, J Klinowski
Chemical Physics Letters
(1999)
306
Values of the Legendre chi and Hurwitz zeta functions at rational arguments
D Cvijović, J Klinowski
Mathematics of Computation
(1999)
68
13C CP/MAS NMR study of anti-HIV-1 agent AZT
W Kolodziejski, J Klinowski
Chemical Physics Letters
(1999)
303
NMR and ESCA chemical shifts in aluminosilicates: A critical discussion
J Klinowski, TL Barr
Accounts of Chemical Research
(1999)
32
Synthesis of new mesostructured aluminophosphates
YZ Khimyak, J Klinowski
Journal of the Chemical Society Faraday Transactions
(1998)
94
The mechanism of channel formation in the mesoporous molecular sieve MCM-41
W Zhou, J Klinowski
Chemical Physics Letters
(1998)
292

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