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

Solid-state 27Al NMR studies of aluminophosphate molecular sieves. Enhanced resolution by quadrupole nutation and double-rotation.
J Rocha, J Klinowski, PJ Barrie, R Jelinek, A Pines
Solid State Nuclear Magnetic Resonance
(1992)
1
EXTRA-FRAMEWORK AL IN ULTRASTABLE ZEOLITE-Y - SOLID-STATE NMR-STUDIES WITH H-1-AL-27 - CROSS-POLARIZATION AND QUADRUPOLE NUTATION UNDER FAST MAGIC-ANGLE SPINNING
J ROCHA, J KLINOWSKI
SYNTHESIS OF MICROPOROUS MATERIALS, VOL 1
(1992)
SOLID-STATE NMR-STUDIES OF A HIGH-TEMPERATURE STRUCTURAL TRANSFORMATION OF HYDRATED POROUS ALUMINOPHOSPHATE VPI-5
HY HE, W KOLODZIEJSKI, J ROCHA, J KLINOWSKI
SYNTHESIS OF MICROPOROUS MATERIALS, VOL 1
(1992)
2-DIMENSIONAL NMR-STUDIES OF THE STRUCTURE AND REACTIVITY OF MOLECULAR-SIEVE CATALYSTS
W KOLODZIEJSKI, J KLINOWSKI
SYNTHESIS OF MICROPOROUS MATERIALS, VOL 1
(1992)
Oxidative damage in Alzheimer’s dementia, and the potential etiopathogenic role of aluminosilicates, microglia and micronutrient interactions
PH Evans, E Yano, J Klinowski, E Peterhans
EXS
(1992)
62
Two-dimensional J-resolved and SUPERCOSY NMR experiments in the solid state.
W Kolodziejski, J Klinowski
Solid state nuclear magnetic resonance
(1992)
1
AL-27 QUADRUPOLE NUTATION AND H-1-AL-27 CROSS-POLARIZATION SOLID-STATE NMR-STUDIES OF ULTRASTABLE ZEOLITE-Y WITH FAST MAGIC-ANGLE SPINNING
J Rocha, SW Carr, J Klinowski
Chemical Physics Letters
(1991)
187
The rehydration of metakaolinite to kaolinite
J Rocha, J Klinowski
Chemical Communications
(1991)
Synthesis of zeolite Na-A from metakaolinite revisited
J Rocha, J Klinowski, JM Adams
Journal of the Chemical Society Faraday Transactions
(1991)
87
Two-dimensional J -scaled 29 Si NMR COSY of highly siliceous mordenite
W Kolodziejski, PJ Barrie, H He, J Klinowski
Journal of the Chemical Society Chemical Communications
(1991)

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