V2CO2MXene从CO2/N2混合气体中选择性吸附CO2的第一性原理计算

二氧化碳作为温室气体中最重要的组成部分,其含量的变化将直接影响全球气候变化,在燃烧后气体中选择性捕获CO₂,对减缓因CO₂浓度过高引发的环境问题具有十分重要的意义.本文采用第一性原理计算的方法,研究了V₂CO₂ MXene材料对CO₂的选择性吸附性能.首先研究了不同官能团V₂CT_X MXene材料的结构和性质,发现V₂CO₂具有良好的稳定性.后研究了V₂CO₂对CO₂的吸附行为,结果表明,当CO₂被水平吸附时,V₂CO₂对CO₂气体分子的吸附能力较强且均满足在高性能吸附剂表面吸附CO₂的理想值(-0.42 eV-0.82 eV),可以适用于探测/捕获CO₂气体分子.此外,进一步研究了相同条件下V<...     

Self-diffusion in core-shell composite 12CO2/13CO2 nanoparticles

A new technique for the generation of multilayered molecular nanoparticles is presented. Core-shell composite nanoparticles of CO(2) with varied composition have been investigated by Fourier-transform infrared spectroscopy over 600 s at 78 K. The isotopically different zones of the particles turned out to have completely different spectra in the nu(3) region: a tub structure (mantle) and a head-and-shoulders structure (core). From the aggregation behavior of both components the particle formation time was found to be 0.1 s. Low-temperature self-diffusion of airborne molecular nanoparticles has been monitored for the first time. The self-diffusion coefficient for (12)CO(2)/(13)CO2 nanocomposites at 78 K was determined from the time evolution of the nu(1) + nu(3) combination band to about 7 x 10(-20) m(2)/s. The work represents a major advance toward nanoengineering of molecular nanoparticles at low temperatures.     

Multiband CO2 oscillator

Multiband output from an atmospheric CO₂ laser has been achieved with intercavity gaseous absorbers. SF₆, NH₃, NH₂D and butane are suitable for this purpose.     

Ultrasound-boosted selectivity of CO in CO2 electrochemical reduction

Among the possible products of CO₂ electrochemical reduction, CO plays a unique and vital role, which can be an ideal feedstock for further reduction to C₂₊ products, and also the important component of syngas that can be used as feedstock for value-added chemicals and fuels. However, it is still a challenge to tune the CO selectivity on Cu electrode. Here we newly construct an ultrasound-assisted electrochemical method for CO₂ reduction, which can tune the selectivity of CO₂ to CO from less than 10% to >80% at −1.18 V versus (vs.) reversible hydrogen electrode (RHE). The partial current density of CO production is significantly improved by 15 times. By in-situ Raman study, the dominating factor for the improved CO production is attributed to the accelerated desorption of *CO intermediate. This work provides a facile method to tune the product selectivity in CO₂ electrochemical reduction.     

The effect of CO on CO2-char gasification

The effect of CO on the gasification of a Polish coal-derived char was investigated in a fluidised bed from 1123 to 1248 K. Rate expressions developed from Ergun's mechanism or a modified three-step reaction mechanism, coupled with Cylindrical Pore Interpolation Model (CPIM) to account for the intra-particle mass transfer, were developed to predict gasification and the effect of CO. Compared to the Ergun's rate expression, the three-step expression has an extra term for p_co, making the inhibition effect of CO more pronounced. The agreement between experimental and numerical results was satisfactory for both models simulating gasification by CO₂/N₂. Then, when CO (1% or 3%) was intentionally introduced in the feed gas (CO₂/N₂), the gasification rates significantly decreased. It was found that the model based on Ergun's mechanism over-estimated the gasification rate, while the results from the model with the three-step mechanism agreed with the experimental data.     

Short delay time UV preionized TEA CO2 laser operating with binary CO2/H2 and CO2/He gas mixtures

In order to obtain short tail-free output laser pulses from a TEA CO₂ laser, parametric study of the laser operation with CO₂/H₂ and CO₂/He binary gas mixtures containing high CO₂ concentrations was carried out. A small scale UV preionized short delay time TEA CO₂ laser was employed. In terms of the maximum extractable output pulse energy and power, the more conventional CO₂/He gas mixture was found to be inferior in comparison with the CO₂/H₂ mixture proposed here.     

CO在MoS2/K2CO3/TiO2上的加H2反应

根据“盐类及氧化物等在高比表面载体上有自发分散倾向”的原理，制备了一种新型的用于由合成气（H2／CO）合成甲醇的催化剂MoS2/K2CO/TiO2(DSA),该催化剂具有较好的耐硫性和对甲醇有较高的选择性，通过对反应条件的教察得出结论：高压、低温、高空速有利于提高醇的选择性。     

Determination of 13CO2/12CO2 Ratio by IRMS and NDIRS

Abstract

Breath tests using ¹³C-labelled substrates require the measurement of ¹³CO₂/¹²CO₂ ratio in breath gas samples. Next to isotope ratio mass spectrometry (IRMS), which is very sensitive but also complex and expensive, alternatively isotope selective nondispersive infrared spectrometry (NDIRS) can be used to determine the ¹³CO₂/¹²CO₂ ratio in expired breath. In this study we compared NDIRS- with IRMS-results to investigate whether the less expensive and very simply to operate NDIRS works as reliable as IRMS. For this purpose we applicated 1-¹³C-Phenylalanine to patients with advanced liver cirrhosis and healthy volunteers and took duplicated breath samples for IRMS and NDIRS at selected time points. Our data show a good correlation between these two methods for a small number of samples as required for simple breath tests. Longer series, where repeated measurements are required on the NDIRS instrument lead to a decreasing correlation. This indicates the superiority of IRMS concerning ¹³CO₂-kinetics over longer time periods.     

On the opto-voltaic measurements in CO and CO2 lasers

We observed and compared the opto-voltaic signals in CO and CO₂ lasers. The signals are obtained capacitively from the water cooling jacket as a low voltage source not influencing the current circuit. We observed from measurement that the output power and the so-called optovoltaic input power have a distinct relationship depending on laser current and cavity parameters. It will be shown that opto-voltaic detection is a very sensitive method especially for CO lasers.     

Multi-line pulsed CO2 oscillator

For use in laser-induced fusion investigations, a CO₂ laser oscillator was developed whose output spectrum contains three simultaneously appearing lines of equal intensity. An etalon filter provided the required wavelength dependent loss.     

Gasdynamic cw CO2 laser

The principles of the physical processes in a high-power gasdynamic cw CO= laser are considered. An equation is derived for the output power, with account taken of the vibrational-nonequilibrium flow of the mixture through the nozzle and of the action of the optical resonator. A theory of the energy of the optical resonator used in the GDL is constructed. The corresponding models of the working medium in the section in which the gas flows through a supersonic nozzle and the optical resonator are presented. The efficiency of a resonator with a uniform field is calculated. The first experiments that have led to realization of the idea of the GDL are described. Experiments that have established for the first time that inactive absorption takes place in the amplifying medium of GDL based on combustion products are also described.Translated from Trudy Ordena Lenina Fizicheskogo Instituta im. P. N. Lebedeva, Vol. 3, pp. 50–114, 1979.     

rf waveguide CO2 laser

Tarnslated from Zhurnal Prikladnoi Spektroskopii, Vol. 54, No. 6, pp. 939–945, June, 1991.     

Spectroscopic Study of CO2 Decomposition in Sealed‐off CO2 Lasers

The CO₂ decomposition in a DC glow discharge in a sealed‐off CO₂ laser mixture (6% CO₂ : 20% N₂ : 74% He) in the pressure range 2 ‐ 22 Torr is investigated. Both the time evolution and the steady‐state CO₂ decomposition are studied by means of time resolved optical emission spectroscopy. A decrease of the time to reach steady‐state values of particles concentrations in the discharge system with decreasing pressure and increasing discharge current is observed. The degree of CO₂ decomposition rapidly decreases with increasing pressure and exhibits only a small increase with increasing discharge current. This behaviour can be explained by the variations of the reduced electrica field strength E/N and of the electron density. Also the influence of the balast volume is discussed in this work.     

High-pressure pulsed CO2 lasers

This paper presents a large body of data allowing one to determine the energy, time, and spectral characteristics of high-pressure pulsed CO₂ lasers over wide ranges of parameters. Institute of High-Current Electronics, Siberian Division of the Russian Academy of Sciences. Translated from Izvestiya Vysshikh Uchebnykh Zavedenii, Fizika, No. 5, pp. 19–28, April, 2000.     

Synthesis of Hierarchical (BiO)2CO3 Nanosheets Microspheres toward Efficient Photocatalystic Reduction of CO2 into CO

In this paper, hierarchical (BiO)₂CO₃ nanosheets microspheres were synthesized with dry ice as carbon source, and characterized by X-ray diffraction (XRD) patterns, X-ray photoelectron spectroscopy (XPS), scanning electron microscope (SEM), high-resolution transmission electron microscopy (HRTEM) and UV–vis diffuse reflectance spectra (DRS). The photocatalytic results showed that (BiO)₂CO₃ display much higher photocatalytic activity than BiOCl and TiO₂ for photocatalystic reduction of CO₂ under UV-visible light. The photocatalytic mechanism study revealled that (BiO)₂CO₃ display better separation efficiency of photoinduced charge carriers due to the large interlayer spacing (1.3675 nm).