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91.
92.
Dr. Antonio A. Ceacero‐Vega Dr. Bernabé Ballesteros Dr. Iustinian Bejan Dr. Ian Barnes Prof. José Albaladejo 《Chemphyschem》2011,12(11):2145-2154
Relative rate coefficients for the gas‐phase reaction of chlorine atoms (Cl) and hydroxyl radicals (OH) with 1,8‐cineole were determined by Fourier‐transform infrared (FTIR) spectroscopy between 285 and 313 K at atmospheric pressure. The temperature dependence of both reactions shows simple Arrhenius behaviour which can be represented by the following expressions (in units of cm3 molecule?1s?1): k(1,8‐cineole+OH)=(6.28±6.53)×10?8exp[(?2549.3±155.7)/T] and k(1,8‐cineole+Cl)=(1.35±1.07)×10?10exp[(?151.6±237.7)/T]. Major products of the titled reactions were identified by solid‐phase microextraction (SPME) coupled to a GC‐MS. Additionally, the first step of the reaction was theoretically studied by ab initio calculations and a reaction mechanism is proposed. 相似文献
93.
The solvothermal reaction of (N(C(4)H(9))(4))(2)[Re(2)Cl(8)] with trifluoroacetic acid and acetic anhydride leads to the new rhenium trifluoroacetate dimer N(C(4)H(9))(4)[Re(2)(OOCCF(3))Cl(6)] (1) and to the rhenium carbonyl dimer Re(2)(mu(2)-Cl)(2)(CO)(8) as the rhenium-reduced byproduct. The reaction of the precursor complex, N(C(4)H(9))(4)[Re(2)(OOCCF(3))Cl(6)] (1), with the organometallic carboxylic acid (CO)(6)Co(2)HCCCOOH leads to the cluster of clusters compound Re(2)(OOCCCHCo(2)(CO)(6))(4)Cl(2) (2), which has the dimer structure of Re(2)(OOCR)(4)Cl(2). Cyclic voltammetric measurements show that Re(2)(OOCCCHCo(2)(CO)(6))(4)Cl(2) (2) has one reduction centered on the dirhenium core and a reduction centered on the cobalt atoms. DFT calculations have been used to rationalize the observed displacements of the voltammetric signals in Re(2)(OOCCCHCo(2)(CO)(6))(4)Cl(2) (2) compared to the parent ligand (CO)(6)Co(2)HCCCOOH and rhenium pivalate. 相似文献
94.
G. Alejandro C. A. Ramos D. Vega M. T. Causa J. Fontcuberta M. Tovar 《Physica B: Condensed Matter》2002,320(1-4):26-29
We report X-ray diffraction, DC-susceptibility, electron spin resonance (ESR), and dilatometry measurements carried out on an La7/8Sr1/8MnO3 single crystal. Thermal expansion was measured along different crystallographic axes using a three-terminal dilatometer. The sharp anomalies observed in the temperature dependence of Δl/l allowed us to locate the Jahn–Teller transition at TJT=285(1) K. ESR experiments were carried out in the paramagnetic regime from 220 to 570 K, at 9.4 GHz. We measured the ESR line width ΔHpp(T) with the magnetic field parallel to the crystallographic directions [1 0 0] and [0 0 1], referred to the orthorhombic (Pbnm) axes. We correlate the temperature dependence of ΔHpp with the structural changes of the lattice. 相似文献
95.
Jean Dolbeault Maria J. Esteban Javier Duoandikoetxea Luis Vega 《Annales Scientifiques de l'école Normale Supérieure》2007,40(6):885-900
We prove some Hardy type inequalities related to the Dirac operator by elementary methods, for a large class of potentials, which even includes measure valued potentials. Optimality is achieved by the Coulomb potential. When potentials are smooth enough, our estimates provide some spectral information on the operator. 相似文献
96.
Siddharth Ray Vladimir Ladizhansky Shimon Vega 《Journal of magnetic resonance (San Diego, Calif. : 1997)》1998,135(2):427-434
The spin dynamics of anS(
)INsystem during the CP mixing time of continuous wave and variable amplitude cross-polarization magic angle spinning (CWCPMAS and VACPMAS) experiments is discussed. The signal enhancement of a low abundantSspin, coupled to a set ofN= 6 coupled spins withI=
, is evaluated as a function of the length of the mixing time. For CWCPMAS this signal is first evaluated in the frequency domain and then transformed to the time domain. These calculations provide some additional insight into the CP spin dynamics and enable a practical approach toward the evaluation of CP signals of large spin systems. In addition the adiabatic character of the ramped VACPMAS experiments is discussed andS-spin signals of a spin system withN= 6 are simulated. Estimates of the upper bounds of the CP signals as a function of the number ofIspins in anS(
)INsystem are given and compared with the calculated values. 相似文献
97.
Cristina Bazgan W. Fernandez de la Vega Marek Karpinski 《Random Structures and Algorithms》2003,23(1):73-91
It is known that large fragments of the class of dense Minimum Constraint Satisfaction (MIN‐CSP) problems do not have polynomial time approximation schemes (PTASs) contrary to their Maximum Constraint Satisfaction analogs. In this paper we prove, somewhat surprisingly, that the minimum satisfaction of dense instances of kSAT ‐formulas, and linear equations mod 2, Ek‐LIN2, do have PTASs for any k. The MIN‐Ek‐LIN2 problems are equivalent to the k‐ary versions of the Nearest Codeword problem, the problem which is known to be exceedingly hard to approximate on general instances. The method of solution of the above problems depends on the development of a new density sampling technique for k‐uniform hypergraphs which could be of independent interest. © 2003 Wiley Periodicals, Inc. Random Struct. Alg., 23: 73–91, 2003 相似文献
98.
Marcos Ghislandi Luis Antonio Sanchez de A. Prado Alejandra de la Vega Oyerviedes Hans Wittich Karl Schulte Ana Barros‐Timmons 《Journal of polymer science. Part A, Polymer chemistry》2008,46(10):3326-3335
Vapor‐grown carbon nanofibers (CNFs) were oxidized and functionalized for atom transfer radical polymerization (ATRP) of tert‐butyl acrylate (t‐BA) from the surface of the CNFs. The materials were characterized by solubility tests, Fourier‐transform infrared (FTIR) spectroscopy, Raman spectroscopy, thermogravimetric analysis (TGA), X‐ray diffraction (XRD), and scanning electron microscopy. The FTIR and electron microscopy results suggest that ATRP process was successfully used to graft poly(tert‐butyl acrylate) (poly(t‐BA)) chains from the surface of the fibers. Raman results strongly indicate the partial degradation of the graphitic layer of CNFs because of the chemical treatments. TGA results suggest that the presence of poly(t‐BA) leads to a decrease of the initial degradation temperature of the fibers. XRD and electron microscopy results indicate that the microstructure of fibers was not destroyed because of the oxidation and functionalization processes. © 2008 Wiley Periodicals, Inc. J Polym Sci Part A: Polym Chem 46: 3326–3335, 2008 相似文献
99.
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