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Results: 1-12 |
Results: 12
The three-dimensional structure of the titanium-centered active site during steady-state catalytic epoxidation of alkenes
Authors: Sankar, G Thomas, JM Catlow, CRA Barker, CM Gleeson, D Kaltsoyannis, N
Citation: G. Sankar et al., The three-dimensional structure of the titanium-centered active site during steady-state catalytic epoxidation of alkenes, J PHYS CH B, 105(38), 2001, pp. 9028-9030
Surface grafting as a route to modifying the gas-sensitive resistor properties of semiconducting oxides: Studies of Ru-grafted SnO2
Authors: Morris, L Williams, DE Kaltsoyannis, N Tocher, DA
Citation: L. Morris et al., Surface grafting as a route to modifying the gas-sensitive resistor properties of semiconducting oxides: Studies of Ru-grafted SnO2, PHYS CHEM P, 3(1), 2001, pp. 132-145
Back bonding without sigma-bonding: a unique pi-complex of dinitrogen withuranium
Authors: Roussel, P Errington, W Kaltsoyannis, N Scott, P
Citation: P. Roussel et al., Back bonding without sigma-bonding: a unique pi-complex of dinitrogen withuranium, J ORGMET CH, 635(1-2), 2001, pp. 69-74
Computational investigation of the geometric structures of [(CN)(5)PtTl(CN)(n)](n-) (n=0, 1, 2 or 3)
Authors: Russo, MR Kaltsoyannis, N
Citation: Mr. Russo et N. Kaltsoyannis, Computational investigation of the geometric structures of [(CN)(5)PtTl(CN)(n)](n-) (n=0, 1, 2 or 3), INORG CHIM, 312(1-2), 2001, pp. 221-225
Probing the nature of acetylene bound to the active site of a NiNa-zeoliteY catalyst by in situ neutron scattering
Authors: Turner, JFC Benmore, CJ Barker, CM Kaltsoyannis, N Thomas, JM David, WIF Catlow, CRA
Citation: Jfc. Turner et al., Probing the nature of acetylene bound to the active site of a NiNa-zeoliteY catalyst by in situ neutron scattering, J PHYS CH B, 104(32), 2000, pp. 7570-7573
Computational study of analogues of the uranyl ion containing the -N=U=N- unit: Density functional theory calculations on UO22+, UON+, UN2, UO(NPH3)(3+), U(NPH3)(2)(4+), [UCl4{NPR3}(2)] (R = H, Me), and [UOCl4{NP(C6H5)(3)}](-)
Authors: Kaltsoyannis, N
Citation: N. Kaltsoyannis, Computational study of analogues of the uranyl ion containing the -N=U=N- unit: Density functional theory calculations on UO22+, UON+, UN2, UO(NPH3)(3+), U(NPH3)(2)(4+), [UCl4{NPR3}(2)] (R = H, Me), and [UOCl4{NP(C6H5)(3)}](-), INORG CHEM, 39(26), 2000, pp. 6009-6017
Electron-transfer and neutral-loss reactions in collisions of CF32+ with argon
Authors: Tafadar, N Kaltsoyannis, N Price, SD
Citation: N. Tafadar et al., Electron-transfer and neutral-loss reactions in collisions of CF32+ with argon, INT J MASS, 192, 1999, pp. 205-214
On the dissociation of the ozone dication
Authors: Champkin, P Kaltsoyannis, N Price, SD
Citation: P. Champkin et al., On the dissociation of the ozone dication, J ELEC SPEC, 105(1), 1999, pp. 21-28
Theoretical study of the geometric and electronic structures of pseudo-octahedral d(0) imido compounds of titanium: the trans influence in mer-[Ti(NR)Cl-2(NH3)(3)] (R = Bu-t, C6H5 or C6H4NO2-4)
Authors: Kaltsoyannis, N Mountford, P
Citation: N. Kaltsoyannis et P. Mountford, Theoretical study of the geometric and electronic structures of pseudo-octahedral d(0) imido compounds of titanium: the trans influence in mer-[Ti(NR)Cl-2(NH3)(3)] (R = Bu-t, C6H5 or C6H4NO2-4), J CHEM S DA, (5), 1999, pp. 781-789
Computational study of the geometric and electronic structures of MN2 (M =Mo or U)
Authors: Brown, KL Kaltsoyannis, N
Citation: Kl. Brown et N. Kaltsoyannis, Computational study of the geometric and electronic structures of MN2 (M =Mo or U), J CHEM S DA, (24), 1999, pp. 4425-4430
Linking metal centres with diimido ligands: synthesis, electronic and molecular structure and electrochemistry of organometallic ditungsten complexes[{WCl2(Ph2PMe)(2)(CO)}(2)(N-X-N)] (X = pi-conjugated organic)
Authors: Hogarth, G Humphrey, DG Kaltsoyannis, N Kim, WS Lee, MY Norman, T Redmond, SP
Citation: G. Hogarth et al., Linking metal centres with diimido ligands: synthesis, electronic and molecular structure and electrochemistry of organometallic ditungsten complexes[{WCl2(Ph2PMe)(2)(CO)}(2)(N-X-N)] (X = pi-conjugated organic), J CHEM S DA, (16), 1999, pp. 2705-2723
Computational studies of the geometric and electronic structures of BF3+, AlF3+, CF32+ and SiF32+
Authors: Kaltsoyannis, N Price, SD
Citation: N. Kaltsoyannis et Sd. Price, Computational studies of the geometric and electronic structures of BF3+, AlF3+, CF32+ and SiF32+, CHEM P LETT, 313(3-4), 1999, pp. 679-684
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