排序方式: 共有48条查询结果,搜索用时 0 毫秒
1.
Sablinskas V Hegelund F Ceponkus J Bariseviciute R Aleksa V Nelander B 《The journal of physical chemistry. A》2005,109(39):8719-8723
Ozonization reaction of ethene in neat film at 77 K was performed. Separation of ethene secondary ozonide from the other products of the reaction was performed by continuous pumping of the reactor. Only the products, which evaporated from the walls of the reactor at 185 K, were transferred to the gas cell. The high-resolution infrared absorption spectrum of gaseous ethene secondary ozonide (C(2)H(4)O(3)) in a static gas long-path absorption cell has been recorded in the 900-1100 cm(-1) spectral region at 185 K. The spectral resolution was 0.003 cm(-1). Analyses of the nu(7)(A) band at 1037.0 cm(-1), the nu(8)(A) band at 956.1 cm(-1), and the nu(18)(B) band at 1082.1 cm(-1) have been performed using the Watson Hamiltonian model (A, reduction; III(r), representation). A set of ground-state rotational and quartic centrifugal distortion constants have been obtained, and upper state spectroscopic constants have been determined for the bands investigated. A local resonance observed in nu(18) is explained as c-Coriolis interaction with nu(10) + nu(11). 相似文献
2.
Ruta Bariseviciute Justinas Ceponkus Alytis Gruodis Valdas Sablinskas 《Central European Journal of Chemistry》2006,4(4):578-591
Ozonization reaction of simple alkenes was studied by means of FT infrared absorption gas spectroscopy. The reaction was performed
at 95 K in neat films of the reactants. IR absorption spectra of the gaseous products were recorded. The spectra were analyzed
combining experimental results with theoretical calculations performed at B3LYP 6-311++G (3df, 3pd) level. We found that among
all theoretically predicted conformers of propene secondary ozonide, only one which has the O-O half-chair configuration for
the five membered ring and the radical attached in the equatorial position was present in the sample. Samples of 1-butene and 1-heptene secondary ozonides consist from two conformers of very
similar energy (ΔH=0.3 kJ/mol). The most stable conformer for both ozonides is the one with O-O half-chair configuration of the five membered
ring and the radical attached in equatorial position and the aliphatic chain in gauche position. The second stable conformer has the aliphatic chain in anti position. 相似文献
3.
George Pitsevich Elena Shalamberidze Alex Malevich Valdas Sablinskas Vytautas Balevicius Lars G. M. Pettersson 《Molecular physics》2017,115(20):2605-2613
The frequencies and intensities of vibration–rotational transitions of water molecules in an argon matrix were calculated for temperatures of 6 and 30 K. The rigid asymmetric top approximation was used with available literature values of the effective rotational constants in the ground and excited vibrational states. The calculations were carried out by taking into account the existence of a non-equilibrium population distribution between the rotational levels of ortho- and para-water isomers. It was assumed that the temperature relaxation of the population of rotational levels is independent of the ortho- and para-isomers. Comparison of the results of the theoretical calculations with experimental literature data shows good agreement for the majority of the rotational structure lines for symmetric and antisymmetric stretching vibrations both in the frequency values and in the values of the relative intensities. 相似文献
4.
Advances in wide bandgap SiC for optoelectronics 总被引:1,自引:0,他引:1
Haiyan Ou Yiyu Ou Aikaterini Argyraki Saskia Schimmel Michl Kaiser Peter Wellmann Margareta K. Linnarsson Valdas Jokubavicius Jianwu Sun Rickard Liljedahl Mikael Syväjärvi 《The European Physical Journal B - Condensed Matter and Complex Systems》2014,87(3):1-16
Silicon carbide (SiC) has played a key role in power electronics thanks to its unique physical properties like wide bandgap, high breakdown field, etc. During the past decade, SiC is also becoming more and more active in optoelectronics thanks to the progress in materials growth and nanofabrication. This paper will review the advances in fluorescent SiC for white light-emitting diodes, covering the poly-crystalline doped SiC source material growth, single crystalline epitaxy growth of fluorescent SiC, and nanofabrication of SiC to enhance the extraction efficiency for fluorescent SiC based white LEDs. 相似文献
5.
A narrowband, pulsed optical parametric oscillator (OPO) whose output coupler is a bulk glass Bragg grating is demonstrated. The OPO is based on periodically poled KTiOPO4 and is pumped by a pulsed, frequency-doubled Nd:YAG laser at 532 nm, generating a signal at 975 nm with a total efficiency of 35%. This novel and compact device shows a spectral bandwidth of 0.16 nm (50 GHz), a decrease by a factor of 20 compared with that when a conventional mirror is used. By using a folded cavity, we demonstrate tunable radiation with a tuning range of 60 nm and maintained spectral bandwidth. 相似文献
6.
A novel technique for characterization of the second-order nonlinearity in nonlinear crystals is presented. It utilizes group-velocity walk-off between femtosecond pulses in type II SHG to achieve three-dimensional resolution of the nonlinearity. The longitudinal and transversal spatial resolution can be set independently. The technique is especially useful for characterizing quasi-phase-matched nonlinear crystals, and it is demonstrated in potassium titanyl phosphate. 相似文献
7.
Gerald Steiner Valdas Sablinskas Wolfgang Seidel Reiner Salzer 《Analytical and bioanalytical chemistry》2009,395(6):1641-1650
Polarization modulation infrared reflection absorption spectroscopy (PM-IRRAS) is a very sensitive technique to characterize
the degree of molecular ordering in thin films on metallic surfaces. This is the first report of the coupling of a PM-IRRAS
microscope to a free electron laser (FEL), a light source of highest brilliance. Some FELs emit in the infrared region and
permit the mapping of molecular properties at high lateral resolution. We studied the molecular orientation of octadecanephosphonic
acid (OPA) attached to a gold surface with microstructured aluminum oxide islands on the gold. The spatial resolution achieved
is 12 μm which corresponds to the diffraction limit of the infrared light used in this study. This is a substantial improvement
compared to previous studies using a PM-IRRA accessory together with a commercial Fourier transform infrared spectrometer,
where the lateral resolution is noise-limited rather than diffraction-limited. The spectral maps reveal that OPA is preferably
attached to the aluminum oxide islands via the bidentate binding mode whereas the tridentate mode is dominating in case of
OPA attached to the gold areas. 相似文献
8.
9.
Raudonis R Bumblauskiene L Jakstas V Pukalskas A Janulis V 《Journal of chromatography. A》2010,1217(49):7690-7698
On-line method, which combines HPLC distribution and post-column reaction, was designed for the search of individual antioxidants. Optimization of the assay was performed evaluating optimal ABTS(+) radical cation concentration in the reactor, reaction time, impact of flow rate, reaction coil length. HPLC-ABTS assay validation in this work was performed by assessing reference antioxidant negative peak areas in radical scavenging chromatogram. Sample free radical scavenging activity is expressed as trolox equivalent antioxidant capacity (TEAC). Optimized and validated method was applied in detection of compounds possessing free radical scavenging ability in complex mixtures. Antioxidant compounds were studied in perilla (Perilla frutescens (L.) Britton var. crispa f. viridis) herbal raw material and its preparations. The HPLC-separated antioxidant compounds were identified using HPLC-photodiode array coupled to mass spectrometer, using a reference mass for determining accurate masses. Radical scavenging characteristics of rosmarinic acid, which is the dominant phenolic compound in medicinal herbal raw material of perilla and its preparations, were confirmed by the calculated TEAC values. Compounds responsible for antioxidant effect in herbal raw materials and herbal preparations were identified, evaluated and compared. 相似文献
10.
Valdas Laurinavicius Julija Razumiene Bogumila Kurtinaitiene Ingrida Lapenaite Irina Bachmatova Liucija Marcinkeviciene Rolandas Meskys Arunas Ramanavicius 《Bioelectrochemistry (Amsterdam, Netherlands)》2002,55(1-2):29-32
This paper focuses on the use of PQQ-dependent enzymes (PQQ enzymes) in amperometrical biosensors and gives emphasis on their innovative designs and applications. The study covers some aspects in the evolution of biosensors based on PQQ enzymes. Main attention is focused on the electrochemical properties of PQQ enzymes as very promising materials for the formation of electrochemical biosensors. Immobilization approaches and redox mediators recently used in PQQ enzymes based biosensors are reviewed. The acceptance of polypyrrole as a very promising immobilization matrix for some PQQ enzymes is discussed. 相似文献