电子振动的
- 与 电子振动的 相关的网络例句 [注:此内容来源于网络,仅供参考]
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The loss of weight of powder during combustion process, phase change, conglobation, grain size, crystalline grain distortion situation, maximum magnetic energy and coercive force were get detaily.
通过差重分析、红外光谱、扫描电子显微镜、能谱、化学相态分析、X射线衍射、振动样品磁强计等检测手段对所得的样品进行燃烧过程重量损失、相态变化、样品的分散性和均匀性、团聚情况、晶粒尺寸计算、晶格畸变情况、样品的最大磁能积、矫顽力等相关的性能进行检测。
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Elastic and inelastic differential and integral cross sections for low-energy vibrational excitation of H2 by electron impact are studied with exact exchange. The resulting coupled integrodifferential equations are solved using a combination of linear-algebraic and R-matrix-propagator techniques.
严格交换势用于研究低能电子与H2分子的弹性和非弹性散射截面,线性代数方法和R-矩阵传播子相结合求解基于振动密耦合方法的积分-微分耦合方程组,由此得到收敛的散射微分截面和积分截面。
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The solvent effects of C24H30O8 have also been investigated based on Onsager self-consistent reaction field model in chloroform, acetone,DMSO and water.
采用密度泛函理论方法,在B3LLYP/6-31G*水平下全优化得到了该化合物的分子几何构型和电子结构;依据Onsager自恰反应场模型考察了其在氯仿、丙酮、二甲亚砜及水等溶剂中的溶剂化作用;基于气相优化结构进行了B3LYP/6-31G*振动分析,用0.9613校正后的主要红外光谱与实验符合得很好。
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The solvent effects of C24H30O8 have also been investigated based on Onsadger self-consistent reaction field model in chloroform, acetone, DMSO and water.
采用密 度泛函理论方法,在B3LYP/6-31G*水平下全优化得到了该化合物的分子几何构型和电子结构;依据Onsager自恰反应场模型考察了其在氯仿、丙酮、二甲亚砜及水等溶剂中的溶剂化作用;基于气相优化结构进行了B3LYP/6-31G*振动分析,用0.9613校正后的主要红外光谱与实验符合得很好。
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In this work,a full optimal calculation on the molecular geometry and electronic structure of C24H30O8 has been performed using density functional theory methods at B3LYP/6-31G* level.The solvent effects of C24H30O8 have also been investigated based on Onsager self-consistent reaction field model in chloroform,acetone,DMSO and water.
采用密度泛函理论方法,在B3LYP/6-31G*水平下全优化得到了该化合物的分子几何构型和电子结构;依据Onsager自恰反应场模型考察了其在氯仿、丙酮、二甲亚砜及水等溶剂中的溶剂化作用;基于气相优化结构进行了B3LYP/6-31G*振动分析,用0.9613校正后的主要红外光谱与实验符合得很好。
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In this work, a full optimal calculation on the molecular geometry and electronic structure of C24H30O8 has been performed using density functional theory methods at B3LYP/6-31G(superscript *) level. The solvent effects of C24H30O8 have also been investigated based on Onsager self-consistent reaction field model in chloroform, acetone, DMSO and water. On the basis of optimized geometry in gas phase the vibration analysis is carried out and the IR principle peaks scaled by 0.9613 are in good agreement with experimental.
采用密度泛函理论方法,在B3LYP/6-31G水平下全优化得到了该化合物的分子几何构型和电子结构;依据Onsager自恰反应场模型考察了其在氯仿、丙酮、二甲亚砜及水等溶剂中的溶剂化作用;基于气相优化结构进行了B3LYP/6-31G振动分析,用0.9613校正后的主要红外光谱与实验符合得很好。
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In this work, a full optimal calculationon the molecular geometry and electronic structure of C24H30O8 has been performed usingdensity functional theory methods at B3LYP/6 - 31G * level. The solvent effects ofC24H30O8 have also been investigated based on Onsager self-consistent reaction field model in chloroform, acetone,DMSO and water.
采用密度泛函理论方法,在B3LLYP/6-31G*水平下全优化得到了该化合物的分子几何构型和电子结构;依据Onsager自恰反应场模型考察了其在氯仿、丙酮、二甲亚砜及水等溶剂中的溶剂化作用;基于气相优化结构进行了B3LYP/6-31G*振动分析,用0.9613校正后的主要红外光谱与实验符合得很好。
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Strong technical force, well equipped, set more than 10 years of professional experience in machinery manufacturing, to set up factories in the country completely on its own production and marketing of machinery manufacturing plant, and the introduction of Japan, Taiwan and other advanced equipment, technologies and the development of manufacturing components A variety of mechanical equipment, there are two main products, hydraulic pressure of 4-, C-type hydraulic pressure, pneumatic pressure bed, air-pressure supercharger oil, gas, hydraulic-rivet machines, membrane switch drum kits pressing machine, dual - Die-pressing machines, pneumatic peeling machine, precision Dijiao machine, precision high-speed presses, open-tilting presses, automatic drilling tapping machines, pneumatic Arm tapping machines, automatic air Tape feeder, vibration Tape feeder, Hydraulic power portfolio, widely applicable in the electronics, electrical appliances, computers, metal, plastics, lighting, bicycles, steam locomotive, machinery and other industries, welcomed by the majority of users, machine-selling Taiwan, Southeast Asia and China's provinces.
公司技术力量雄厚,设备齐全精良,集十余年的专业机械制造经验,设厂于国内完全的自行产销的机械制造工厂,并引进了日本、台湾等先进设备、技术及元件开发制造多种机械设备,主要产品有二、四柱油压压床,C型油压压床,气压压床,空油增压压床,气油压式铆钉机,薄膜开关鼓包热压机,双面模热压机,气压剥皮机,精密滴胶机,精密高速冲床,开式可倾压力机,自动钻孔攻牙机,气动旋臂攻牙机,空气自动送料机,振动送料机,油压动力组合等,广泛适用于电子、电器、电脑、五金、塑胶、灯饰、自行车、汽机车、机械等各种行业,深受广大用户欢迎,机械广销台湾,东南亚及中国各省。
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UV absorptions of the complexes are redshifted compared with those of the monomers owing to the less LUMO-HOMO energy gap. IR frequencies of N-H bonds in the complexes are lessened due to the formation of hydrogen bonds.
LUMO-HOMO能隙的减小使电子光谱吸收峰发生红移,氢键的形成削弱了单体原来的N-H键,使红外振动频率变小。
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It has also been described that the different interaction between host and the anions and the effect of electron – withdrawing group substitution on host-guest interaction from geometry features, frequency analyses, NBO analyses and frontier orbital of interaction.
本文还从几何构型、振动光谱、NBO分析及前线轨道等方面来阐述β-三氰基乙烯取代杯[4]吡咯与不同阴离子氢键相互作用的本质以及吸电子取代基的引入对杯[4]吡咯与F-和Cl-之间主-客体相互作用的影响。
- 推荐网络例句
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However, as the name(read-only memory)implies, CD disks cannot be written onorchanged in any way.
然而,正如其名字所指出的那样,CD盘不能写,也不能用任何方式改变其内容。
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Galvanizes steel pallet is mainly export which suits standard packing of European Union, the North America. galvanizes steel pallet is suitable to heavy rack. Pallet surface can design plate type, corrugated and the gap form, satisfies the different requirements.
镀锌钢托盘多用于出口,替代木托盘,免薰蒸,符合欧盟、北美各国对出口货物包装材料的法令要求;喷涂钢托盘适用于重载上货架之用,托盘表面根据需要制作成平板状、波纹状及间隔形式,满足不同的使用要求。
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A single payment file can be uploaded from an ERP system to effect all pan-China RMB payments and overseas payments in all currencies.
付款指令文件可从您的 ERP 系统上传到我们的电子银行系统来只是国内及对海外各种币种付款。