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81.
本文首先优化出Fe2+和水分子相互作用的Lennard-Jones(12/6)势能模型中的2个参数:εIW=0.180 kcal·mol-1和σIW=0.2885 nm。然后在298.15 K和573 K 温度条件下,用这个势能模型去运行Fe2+极稀水溶液系统的分子动力学模拟。模拟的结果显示,Fe2+的第一和第二水化壳层的结构和动力学性质与实验的,以及其他势能模型模拟出的结果一致。模拟的同时获得了关于RWK2水分子模型内部结构变化的新信息。此外,模拟揭示了温度变化对Fe2+水化结构和动力学性质的影响。 相似文献
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Simulation and experimental results for high repetition rate all-normal dispersion Yb:fiber ring lasers are demonstrated for the cavity dispersion from 0.01 to 0.025 ps 2 .The simulation shows that the pulse spectrum has the potential to reach>30 nm for the dispersion of 0.014 ps 2 under practical pump power. This potential is proved by the experiment.Maximum spectral width of 30 nm is achieved at the repetition rate of 285 MHz under the 850-mW pump power.Average output power is 550 mW and dechirped pulse is 78 fs. 相似文献
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This paper illustrates the design and simulation of a unique 500 MHz single-cell superconducting radio frequency cavity with a fluted beam pipe and a coaxial-type fundamental power coupler. The simulation results show that the cavity has a high r/Q value, a low peak surface field and a large beam aperture, so it can be a candidate cavity for high current accelerators. With the help of a fluted beam tube, almost all the higher order modes can propagate out of the cavity, especially the first two dipole modes, TE111 and TM110, and the first higher monopole mode, TM011. The external quality factor of the coaxial fundamental power coupler is optimized to 1.2×105, which will be useful when it is applied in the light source storage ring. 相似文献
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Two semiconductor saturable absorber mirrors (SESAMs), of which one is coated with 50% reflection film on the top and the other is not, were contrastively studied in passively mode-locked solid-state lasers which were pumped by low output power laser diode (LD). Experiments have shown that reducing the modulation depth of SESAM by coating partial reflection film, whose reflectivity is higher than that between SESAM and air interface, is an effective method to get continuous wave (CW) mode-locking instead of Q-switched mode-locking (QML) in low power pumped solid-state lasers. A simple Nd:YVO4 laser pumped by low power LD, in which no water-cooling system was used, could obtain CW mode-locking by the 50% reflector coated SESAM with average output power of ~ 20 mW. 相似文献
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We have demonstrated passive mode-locking in a diode-end-pumped Nd:YV04 laser using two kinds of semiconductor absorbers whose relaxation region comes from Ino.2sGao.75As grown at low temperature (LT) and GaAs/air interface respectively. Mode-locking, using absorbers of the GaAs/air interface relaxation region, has the characteristics of less Q-switching tendency and higher average output power than that using absorbers of LT In0.25Ga0.75As relaxation region, but is not as stable as the latter. 相似文献