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991.
Zi‐Yi Yu Han Lai Wen‐Juan Zhao Rui Wu Xue‐Sen Liu Li‐Hua Gan 《International journal of quantum chemistry》2017,117(19)
To elucidate the structure of a compound is a necessary step for its practical applications. To study the structure and properties of metal sulfide fullerene Sc2S@C88 detected by mass spectrometry, 11 194 isomers of C88 and 33 isomers of Sc2S@C88 were systematically examined by density functional theory calculations. The calculations show that the two lowest‐energy isomers are Sc2S@C88:81 738 (IPR‐35) and Sc2S@C88:81 735 (IPR‐32), followed by Sc2S@C88:81 729 (IPR‐26), Sc2S@C88:81 712 (IPR‐9), and Sc2S@C88:81 733 (IPR‐30). Structural analysis shows that the first two energetically favored isomers are bridged by the third and fifth energetically favored isomers, which can transfer into each other via direct Stone–Wales rotation. The calculations of temperature effect show that the first two favored isomers become dominant forms of Sc2S@C88 with decreasing temperature and may coexist in the soot. This structural convertibility among favored isomers of Sc2S@C88 suggest a hidden rule that birds of a feather flock together in metal sulfide fullerenes. This rule may decrease the range of candidate cages for the structural identification of a metal sulfide fullerene. IR spectra are simulated for helping the future experimental identification of Sc2S@C88. 相似文献
992.
Cheng Wang Yuxin Leng Chuang Li Baozhen Zhao Zhizhan Xu 《Optics & Laser Technology》2010,42(4):657-661
A decentered grating stretcher for chirped pulse amplification systems is analyzed with oblique meridional ray tracing. Several formulae and conclusions are developed to design and optimize the stretcher. On basis of an analytical phase expression with an explicit significance, the expressions of the second-, third- and approximate fourth-order phases at the central wavelength are presented with only independent variables. These simplify the parameter design for this kind of stretcher and the phase compensation design of the whole amplifier system, which has been demonstrated with a practical example. 相似文献
993.
We report our results on effective third-harmonic generation (THG) by cascading quasi-phase-matched second-harmonic and sum-frequency generation in a dual-period-periodically-poled KTP crystal. Significant improvement of the output powers were achieved for the 440 nm blue light and 660 nm red light based on Q-switched frequency-tripling and frequency-doubling 1319-nm radiation inside an adhesive-free bond composite Nd:YAG laser. The highest output powers of 197 mW and 1.19 W were achieved for the blue and red light at the corresponding input powers of 12.9 and 17.1 W for the diode laser. 相似文献
994.
995.
D. Z. Li X. D. Xu S. S. Cheng D. H. Zhou F. Wu Z. W. Zhao C. T. Xia J. Xu J. Zhang H. M. Zhu X. Y. Chen 《Applied physics. B, Lasers and optics》2010,101(1-2):199-205
Nd:CaYAlO4 single crystal has been grown by the Czochralski technique. The cell parameters were analyzed with X-ray diffraction (XRD). The polarized absorption spectra, the polarized fluorescence spectra, and the fluorescence decay curve of the crystal were measured at room temperature. The spectroscopic parameters were determined by Judd–Ofelt theory and Fuchtbauer–Ladenburg formula. The effective intensity parameters Ω 2, Ω 4, and Ω 6 were obtained to be 2.19, 8.16, and 8.57×10?20 cm2, respectively. The calculated radiative probabilities, branching ratios, and radiative lifetime were also evaluated for the 4F3/2 excited state using the calculated intensity parameters. The results indicate Nd:CaYAlO4 has potential as a laser gain medium for ultrashort laser system. 相似文献
996.
Back Cover: Improved Electrochromic Performance of Poly(3,4‐ethylenedioxythiophene) by Incorporating a Three‐Dimensionally Ordered Macroporous Structure (Chem. Asian J. 20/2016) 下载免费PDF全文
997.
为了保证卫星发射前的地面姿轨控半物理试验的顺利进行,研制了姿轨控分系统半物理仿真地面测试系统。为了满足相关类似卫星型号的通用化测试,本套仿真测试系统采用通用模块化的设计架构,同时采用现今主流的PXI总线测试技术(配合VPC转接电路板)。使用标准通用cPCI总线板卡以及部分自制FPGA可编程cPCI总线板卡实现各测试模块的功能。这种架构不仅能实现功能模块化,便于后续的功能扩展及维修,同时具有可靠性高、搭建时间快、可维护性强的优点,且体积小,稳定性强,能适应不同测试对象的测试环境条件,适合长途运输。本文介绍了系统的总体设计结构,重点介绍了模拟总体电源、动力学仿真机、电信号源、程序加载以及外围设备等硬件系统功能,以及相关配套软件的基本功能。测试系统经过与卫星的星地联试,功能性及使用性均得到了验证,测试结论符合设计之初功能性及通用化的构想。 相似文献
998.
999.
Tian Jin Lu Zhao Maolin Huang Yan Yue Zhe-Bin Zheng Won-Hun Ham 《Tetrahedron: Asymmetry》2017,28(5):725-729
Concise stereoselective syntheses of (?)-clavaminol A and deacetyl (+)-clavaminol H have been achieved from simple starting materials. Highlights of the synthesis for (?)-clavaminol A include a highly diastereoselective chelation-controlled hydride reduction of an amino ketone to give the anti amino alcohol directly, and NaBH4-mediated dehalogenation. The main synthetic approach for deacetyl (+)-clavaminol H features a highly diastereoselective chelation-controlled hydride reduction of the amino ketone to construct the anti amino alcohol and a palladium catalyzed hydrogenation reaction at the final step. 相似文献