All Outputs (18)

Experimental evidence for the molecular molybdenum fluorides MoF to MoF6: a matrix isolation and DFT investigation (2022)
Journal Article
Sakr, A., Snelling, H. V., & Young, N. A. (2022). Experimental evidence for the molecular molybdenum fluorides MoF to MoF6: a matrix isolation and DFT investigation. New journal of chemistry = Nouveau journal de chimie, 46(20), 9666-9684. https://doi.org/10.1039/d1nj06062g

All of the molecular molybdenum fluorides, MoF to MoF6, have been synthesised from the reaction of thermally evaporated molybdenum atoms with fluorine molecules and atoms, trapped in argon matrices, and characterised by matrix isolation IR spectrosco... Read More about Experimental evidence for the molecular molybdenum fluorides MoF to MoF6: a matrix isolation and DFT investigation.

Searching for Monomeric Nickel Tetrafluoride: Unravelling Infrared Matrix Isolation Spectra of Higher Nickel Fluorides (2020)
Journal Article
Li, L., Sakr, A. K., Schlöder, T., Klein, S., Beckers, H., Kitsaras, M., …Riedel, S. (2021). Searching for Monomeric Nickel Tetrafluoride: Unravelling Infrared Matrix Isolation Spectra of Higher Nickel Fluorides. Angewandte Chemie, 60(12), 6391-6394. https://doi.org/10.1002/anie.202015501

Binary transition metal fluorides are textbook examples combining complex electronic features with most fundamental molecular structures. High‐valent nickel fluorides are among the strongest known fluorinating and oxidizing agents, but there is a lac... Read More about Searching for Monomeric Nickel Tetrafluoride: Unravelling Infrared Matrix Isolation Spectra of Higher Nickel Fluorides.

X-ray absorption study of platinum and palladium atoms in argon matrices: Evidence for platinum in a substitutional site and a short Pd–Ar interaction (2018)
Journal Article
Harris, N., Sakr, A. K., Snelling, H. V., & Young, N. A. (2018). X-ray absorption study of platinum and palladium atoms in argon matrices: Evidence for platinum in a substitutional site and a short Pd–Ar interaction. Journal of molecular structure, 1172, 80-88. https://doi.org/10.1016/j.molstruc.2018.06.024

The Pt L3-edge X-ray absorption spectrum of Pt atoms generated in a hollow cathode sputtering device and trapped in an Ar matrix yielded a PtAr distance of 3.78(4) Å with a coordination number of ca. 12 which confirms the evidence from electronic abs... Read More about X-ray absorption study of platinum and palladium atoms in argon matrices: Evidence for platinum in a substitutional site and a short Pd–Ar interaction.

How inert, perturbing, or interacting are cryogenic matrices? A combined spectroscopic (infrared, electronic, and x-ray absorption) and DFT investigation of matrix-isolated Iron, Cobalt, Nickel, and Zinc Dibromides (2018)
Journal Article
Wilkin, O. M., Harris, N., Rooms, J. F., Dixon, E. L., Bridgeman, A. J., & Young, N. A. (2018). How inert, perturbing, or interacting are cryogenic matrices? A combined spectroscopic (infrared, electronic, and x-ray absorption) and DFT investigation of matrix-isolated Iron, Cobalt, Nickel, and Zinc Dibromides. The journal of physical chemistry. A, 122(8), 1994-2029. https://doi.org/10.1021/acs.jpca.7b09734

The interactions of FeBr2, CoBr2, NiBr2 and ZnBr2 with Ne, Ar, Kr, Xe, CH4 and N2 matrices have been investigated using IR, electronic absorption and X-ray absorption spectroscopies, as well as DFT calculations. ZnBr2 is linear in all the matrices. N... Read More about How inert, perturbing, or interacting are cryogenic matrices? A combined spectroscopic (infrared, electronic, and x-ray absorption) and DFT investigation of matrix-isolated Iron, Cobalt, Nickel, and Zinc Dibromides.

A matrix isolation and computational study of molecular palladium fluorides : does PdF₆ exist? (2016)
Journal Article
Wilson, A. V., Nguyen, T., Brosi, F., Wang, X., Andrews, L., Riedel, S., …Young, N. A. (2016). A matrix isolation and computational study of molecular palladium fluorides : does PdF₆ exist?. Inorganic chemistry, 55(3), 1108-1123. https://doi.org/10.1021/acs.inorgchem.5b02273

Palladium atoms generated by thermal evaporation and laser ablation were reacted with and trapped in F₂ /Ar, F₂ /Ne, and neat F₂ matrices. The products were characterized by electronic absorption and infrared spectroscopy, together with relativistic... Read More about A matrix isolation and computational study of molecular palladium fluorides : does PdF₆ exist?.

Spectroscopic and computational insight into the activation of O2 by the mononuclear Cu center in polysaccharide monooxygenases (2014)
Journal Article
Kjaergaard, C. H., Qayyum, M. F., Wong, S. D., Xu, F., Hemsworth, G. R., Walton, D. J., …Solomon, E. I. (2014). Spectroscopic and computational insight into the activation of O2 by the mononuclear Cu center in polysaccharide monooxygenases. Proceedings of the National Academy of Sciences of the United States of America, 111(24), 8797-8802. https://doi.org/10.1073/pnas.1408115111

Strategies for O₂ activation by copper enzymes were recently expanded to include mononuclear Cu sites, with the discovery of the copper-dependent polysaccharide monooxygenases, also classified as auxiliary-activity enzymes 9–11 (AA9-11). These enzyme... Read More about Spectroscopic and computational insight into the activation of O2 by the mononuclear Cu center in polysaccharide monooxygenases.

Using atomic orbitals and kinesthetic learning to authentically derive molecular stretching vibrations (2013)
Journal Article
Bridgeman, A. J., Schmidt, T. W., & Young, N. A. (2013). Using atomic orbitals and kinesthetic learning to authentically derive molecular stretching vibrations. Journal of chemical education, 90(7), 889-893. https://doi.org/10.1021/ed300045q

The stretching modes of MLx complexes have the same symmetry as the atomic orbitals on M that are used to form its σ bonds. In the exercise suggested here, the atomic orbitals are used to derive the form of the stretching modes without the need for f... Read More about Using atomic orbitals and kinesthetic learning to authentically derive molecular stretching vibrations.

Main group coordination chemistry at low temperatures: A review of matrix isolated Group 12 to Group 18 complexes (2012)
Journal Article
Young, N. (2013). Main group coordination chemistry at low temperatures: A review of matrix isolated Group 12 to Group 18 complexes. Coordination chemistry reviews, 257(42891), 956 - 1010. https://doi.org/10.1016/j.ccr.2012.10.013

The available data on main group (Groups 12-18) Lewis acid-base, donor-acceptor, charge-transfer andvan der Waals complexes stabilised by matrix isolation techniques are presented, tabulated and evaluatedin conjunction with data from complementary ga... Read More about Main group coordination chemistry at low temperatures: A review of matrix isolated Group 12 to Group 18 complexes.

Preparation, structural characterization, and thermal ammonolysis of two novel dimeric transition silylamide complexes (2011)
Journal Article
Cheng, F., Hope, C. N., Archibald, S. J., Bradley, J. S., Clark, S., Francesconi, M. G., …Lefebvre, F. (2011). Preparation, structural characterization, and thermal ammonolysis of two novel dimeric transition silylamide complexes. International Journal of Applied Ceramic Technology, 8(2), 467-481. https://doi.org/10.1111/j.1744-7402.2009.02452.x

The preparation and molecular structures of two novel dimeric transition metal silylamide complexes {Li0.5Zr[NHSi(NMe2)3]1.5[NSi(NMe2)3]0.5[μ -NSi(NMe2)3]}2 and {Li0.5Hf[NHSi(NMe2)3]1.5[NSi(NMe2)3]0.5[μ-NSi(NMe2)3]}2 with a tetrahedral coordination e... Read More about Preparation, structural characterization, and thermal ammonolysis of two novel dimeric transition silylamide complexes.

Investigation of the stability of Co-doped apatite ionic conductors in NH3 (2010)
Journal Article
Headspith, D. A., Orera, A., Slater, P. R., Young, N. A., & Francesconi, M. G. (2010). Investigation of the stability of Co-doped apatite ionic conductors in NH3. Journal of Solid State Chemistry, 183(12), 2746-2758. https://doi.org/10.1016/j.jssc.2010.08.033

Hydrogen powered solid oxide fuel cells (SOFCs) are of enormous interest as devices for the efficient and clean production of electrical energy. However, a number of problems linked to hydrogen production, storage and transportation are slowing down... Read More about Investigation of the stability of Co-doped apatite ionic conductors in NH3.

A mechanistic study of the low pressure pyrolysis of linear siloxanes (2009)
Journal Article
Almond, M. J., Becerra, R., Bowes, S. J., Cannady, J. P., Ogden, J. S., Young, N. A., & Walsh, R. (2009). A mechanistic study of the low pressure pyrolysis of linear siloxanes. Physical chemistry chemical physics : PCCP, 11(40), 9259-9267. https://doi.org/10.1039/b910549b

Matrix isolation IR spectroscopy has been used to study the vacuum pyrolysis of 1,1,3,3-tetramethyldisiloxane (L1), 1,1,3,3,5,5-hexamethyltrisiloxane (L2) and 3H,5H-octamethyltetrasiloxane (L3) at ca. 1000 K in a flow reactor at low pressures. The hy... Read More about A mechanistic study of the low pressure pyrolysis of linear siloxanes.

Mercury–fluorine interactions: a matrix isolation investigation of Hg⋯F2, HgF2 and HgF4 in argon matrices (2008)
Journal Article
Rooms, J. F., Wilson, A. V., Harvey, I., Bridgeman, A. J., & Young, N. A. (2008). Mercury–fluorine interactions: a matrix isolation investigation of Hg⋯F2, HgF2 and HgF4 in argon matrices. Physical chemistry chemical physics : PCCP, 10(31), 4594-4605. https://doi.org/10.1039/b805608k

HgF2 and Hg have been trapped in dilute F2/Ar and neat F2 matrices, subjected to UV-Vis and vac-UV photolysis and annealing, with the products identified by FTIR, UV-Vis-NIR and Hg L3-edge XAFS spectroscopic techniques. Whilst there was no convincing... Read More about Mercury–fluorine interactions: a matrix isolation investigation of Hg⋯F2, HgF2 and HgF4 in argon matrices.

TiF2: Linear or bent? (2008)
Journal Article
Wilson, A. V., Roberts, A. J., & Young, N. A. (2008). TiF2: Linear or bent?. Angewandte Chemie, 47(9), 1774-1776. https://doi.org/10.1002/anie.200704667

Calling nonlinearity into question: When Ti atoms are isolated in fluorine-doped argon matrices, TiF 4 , TiF 3 , TiF 2 , and TiF are identified by their IR spectra. The Ti isotope pattern observed for the ν 3 mode of TiF 2 is indistinguishable from t... Read More about TiF2: Linear or bent?.

Synthesis and characterization of nanoporous phospho-tungstate organic-inorganic hybrid materials (2008)
Journal Article
Rao, K. N., Dingwall, L. D., Gai, P. L., Lee, A. F., Tavener, S. J., Young, N. A., & Wilson, K. (2008). Synthesis and characterization of nanoporous phospho-tungstate organic-inorganic hybrid materials. Journal of Materials Chemistry, 18(8), 868-874. https://doi.org/10.1039/b715826b

Nanoporous phospho-tungstate organic-inorganic hybrid materials have been synthesized from sodium tungstate and mono-n-dodecyl phosphate (MDP), which was used as both surfactant and phosphorus precursor. These hybrid materials were thoroughly charact... Read More about Synthesis and characterization of nanoporous phospho-tungstate organic-inorganic hybrid materials.

Preparation of mesoporous Pd/Si3N4nanocomposites as heterogeneous catalysts via three different chemical routes (2006)
Journal Article
Cheng, F., Kelly, S. M., Young, N. A., Hope, C. N., Beverley, K., Francesconi, M. G., …Lefebvre, F. (2006). Preparation of mesoporous Pd/Si3N4nanocomposites as heterogeneous catalysts via three different chemical routes. Chemistry of materials : a publication of the American Chemical Society, 18(25), 5996-6005. https://doi.org/10.1021/cm061106h

Mesoporous palladium/silicon nitride nanocomposites were prepared via three different chemical routes to generate simultaneous control of the solid-state morphology of the palladium nanoparticles and that of the silicon nitride support at the same ti... Read More about Preparation of mesoporous Pd/Si3N4nanocomposites as heterogeneous catalysts via three different chemical routes.

Magnetic coupling and long-range order in the spin-chain sulfide Ba 2CoS3 (2006)
Journal Article
Barnes, A. D., Baikie, T., Hardy, V., Lepetit, M. B., Maignan, A., Young, N. A., & Francesconi, M. G. (2006). Magnetic coupling and long-range order in the spin-chain sulfide Ba 2CoS3. Journal of Materials Chemistry, 16(34), 3489-3502. https://doi.org/10.1039/b605178b

In this paper, we report on the magnetic properties of Ba 2CoS3, a spin-chain compound recently found to be the first Co2+-containing one-dimensional sulfide to show metallic-like conductivity and negative magnetoresistance. We carried out an in-dept... Read More about Magnetic coupling and long-range order in the spin-chain sulfide Ba 2CoS3.

General method of preparation of mesoporous M/Si3N4 nano-composites via a non-aqueous sol-gel route (2005)
Journal Article
Cheng, F., Kelly, S. M., Young, N. A., Clark, S., Francesconi, M. G., Lefebvre, F., & Bradley, J. S. (2005). General method of preparation of mesoporous M/Si3N4 nano-composites via a non-aqueous sol-gel route. Chemical communications : Chem comm / the Royal Society of Chemistry, 5662-5664. https://doi.org/10.1039/b511790a

We report a general method for the preparation of transition-metal silicon nitride nanocomposites; for example, mesoporous Pd-Si 3 N 4 nanocomposite materials with high surface area were prepared by pyrolysis of a silicon palladium imide-chloride co... Read More about General method of preparation of mesoporous M/Si3N4 nano-composites via a non-aqueous sol-gel route.

Ba2−xSrxPdO2F2(0 ≤ x ≤ 1.5): The first palladium-oxide-fluorides (2003)
Journal Article
Baikie, T., Dixon, E. L., Young, N. A., Rooms, J. F., & Francesconi, M. G. (2003). Ba2−xSrxPdO2F2(0 ≤ x ≤ 1.5): The first palladium-oxide-fluorides. Chemical communications : Chem comm / the Royal Society of Chemistry, 3(13), 1580-1581. https://doi.org/10.1039/b303402j

The first series of alkaline-earth palladium oxide-fluorides Ba2−xSrxPdO2F2(0 ≤ x ≤ 1.5) display the T′ structure (Nd2CuO4) instead of the predicted T structure (La2CuO4), showing that electronic factors prevail over steric factors.