Search results for "transition"
showing 10 items of 3988 documents
Konvergenz von Absorption und Fluoreszenz bei gekreuzt konjugierten Oligomeren aus Chalkon-Bausteinen
1999
The absorption and fluorescence spectra of two series of chalcone oligomers (1a–d) and (2a–d) are reported. Due to small or vanishing orbital coefficients (HMO calculation) within the cross-conjugated systems, the bathochromic shifts caused by the extension of the chains are modest. The effective conjugation lengths amount to 6 and 14 chalcone building blocks in the absorptions of the series 1 and 2. The convergence of the fluorescence bands is already reached in 1d and 2d with 4 and 8 enone units, respectively. Besides the uniform or alternate arrangement of the chalcone building blocks, the positions of the propoxy substituents show a considerable influence on the electronic transitions p…
Spin-Transition in [Fe(II)(2,6-Bis-(Benzimidazol-2′-yl)pyridine)2] (CIO4)2: Hysteresis Effect Dependent on the Matrix
1999
Abstract Far-Infrared spectroscopical investigation of the spin-crossover in [Fe(II)(2,6-bis-(benzimidazol-2′-yl)-pyridine)2] (CIO4)2 exhibits a hysteresis in both CsI and polyethylene matrices within temperature cycles between 100K and 520K. The hysteresis broadening is dependent on the matrix and bigger in CsI. This can be explained due to polarity and hydrogen bonding. Two low spin vibrations, LS1 at 437 cm−1 and LS2 at 424cm−1, are observed. On heating from 100K to 520K: during LS1 decreases, the LS2 raises temporarily, until both LS1 and LS2 disappear; for the HS only one raising species was observed. This gives raise to assume two different sub-lattices.
Spin crossover in mononuclear and binuclear iron(III) complexes with pentadentate Schiff-base ligands
2000
Abstract A series of mononuclear hexacoordinate iron(III) complexes, [Fe( 5 L )(py)]BPh 4 , and binuclear hexacoordinate iron(III) complexes, [( 5 L )Fe(μ 2 -bpy)Fe( 5 L )](BPh 4 ) 2 , has been prepared and their magnetic properties were investigated; the pentadentate ligands were derivatives of 5 L =saldptn=N,N′-bis(2-hydroxybenzyliden)-1,7-diamino-4-azaheptane. Temperature variation of the effective magnetic moment for them shows that a spin transition from the low-spin to the high-spin state occurs. The magnetic data were fitted to an Ising-like model appropriate for the mono- and binuclear systems.
The Nonanuclear [Mo(IV) {(CN)Fe(III)(3-ethoxy-saldptn)}8]Cl4 Complex Compound Exhibits Multiple Spin Transitions Observed by Mössbauer Spectroscopy
2004
The pentadentate ligand 3-EO-5LH2 = 3-ethoxy-saldptn = N,N′-bis(3-ethoxy-1-hydroxy-2-benzyliden)-1,7-diamino-4-azaheptane has been prepared by a Schiff base condensation between 1,7-diamino-4-azaheptane and the corresponding 3-ethoxy-salicyaldehyde. 3-EO-5LH2 is a sterical extention to 5LH2. Its complexation with Fe(III) gave the high-spin (S = 5/2) complex of [Fe(III)(3-EO-5L)Cl]. This precursor was combined with [Mo(CN)8]4− and a blue nonanuclear cluster [Mo(IV){(CN)Fe(III)(3-EO-5L)}8]Cl4 resulted. This starshaped nonanuclear compound is a high-spin system at room temperature. On cooling to 10 K some of the eight iron(III) centers switched to the low-spin state as proven by Mossbauer spec…
Effect of N-substitution in multinuclear complexes allows interplay between magnetic states and multistability investigated by Mössbauer spectroscopy
2006
A series of pentadentate ligands N-X-5LH2 (X=H, Methyl, Benzyl)=N-X-saldptn (4-X-N,N′-bis(l-hydroxy-2-benzylidene)-1,7-diamino-4-azaheptane) has been prepared by a Schiff base condensation between 1,7-diamino-4-X-azaheptane and salicylaldehyde. Complexation with Fe(III) yields a series of high-spin (S=5/2) complexes of [FeIII(N-X-5L)Cl]. Such precursors were combined with [Mo(CN)8]4− and a series of blue nonanuclear cluster compounds [MoIV(CN)FeIII(N-X-5L)8]Cl4 resulted. Such star-shaped nonanuclear compounds are high-spin systems at room temperature. On cooling to 10K some of the iron(III) centers switched to the low-spin state as proven by Mossbauer spectra, i.e. multiple electronic trans…
Electroactivation of Transition Metal Redox Couples for the Carbonylation of Alcohols to Dialkylcarbonates
1998
Electrochemical systems which promote the carbonylation of methanol to dimethylcarbonate, based on the anodic activation of transition metal redox couples, or the Br−/Br2 couple, are poorly active for the carbonylation of ethanol to diethylcarbonate at room temperature and atmospheric pressure. Positive results have been obtained by combined addiction of PdBr2 and Bu4NBr to the system. In this way yields up to 50% in diethylcarbonate were obtained, with very good conductivities in long range electrolyses.
Prediction of Indices of Refraction and Glass Transition Temperatures of Linear Polymers by Using Graph Theoretical Indices
2002
Graph theoretical indices were exclusively used in the prediction of indices of refraction, n, and glass transition temperatures, Tg, into a group of addition polymers. Models with 10 variables were selected for the prediction of n (r = 0.981, SEE = 0.0147) and Tg/M (r = 0.946, SEE = 0.439). The average errors in the predictions were 0.69% and 12.7% for n and Tg, respectively. The descriptors involved in these models were calculated from the structures of the monomers.
On lead-scandium tantalate solid solutions with high electrocaloric effect
1992
Abstract The PbSc0,5Ta0,5O3 solutions are found to be a useful material for active elements of microcryogenic devices based on electrocaloric effect. A temperature difference of ΔT = 1. 0-1.8 K at field intensities 20–30 kV/cm in the interval of 210–310 K can be achieved by simultaneous or separate introducing of Sb and Co ions in B-sites of the lattice. The most important contribution to the electrocaloric effect is due to field-induced Fn3m → R3m phase transition in the case of high ordering of B-ions in the perovskite structure ABO3.
Investigations of the Microstructure of Lipid Interface Films
1990
The phase behaviour of phospholipid monolayers at electrolyte/gas interfaces is studied by fluorescence microscopy. At the LE/LC phase transition, phase separation leads to a Wigner-type lattice structure. The observations are quantified using digital image processing. The results show that the phase transition comprises three different regimes.
Low-lying Rydberg states of HCl.
2008
Vertical excitation energies belonging to some different Rydberg series of hydrogen chloride have been determined with a coupled-cluster theoretical approach. These excitation energies have allowed us to calculate electric dipole transition intensities in HCl and allow additional assessment of the calculation approach presently used to provide an adequate description of the valence and Rydberg states of HCl. The molecular quantum defect orbital has been applied to the calculation of oscillator strengths. In particular, new insight is given on the assignment of states as the R1Pi, the 1Delta(4dpi and 5ppi), the 1Sigma+(4dpi), and the nddelta(1Pi, 1Phi) and 4f states.