atomic charge
英 [əˈtɒmɪk tʃɑːdʒ]
美 [əˈtɑːmɪk tʃɑːrdʒ]
网络 原子電荷; 电荷布居数
双语例句
- Atomic partial densities of states, charge density distributions, and surface band structures are calculated and analyzed on both Ga terminated surface and N terminated surface.
分析了得到的各原子分态密度、面电荷密度分布以及表面能带结构等性质，比较了GaN（001）的Ga端表面和N端表面两种情况。 - Some new technologies using in our system were presented, including user-management technology based on layered model, service-management technology based on Web Service and charge-management technology based on atomic charge unit.
针对基于层次化模式的用户管理、基于WEBService的服务集成与管理和基于最小计费单元的计费管理等若干关键技术进行了较深入的讨论，并提出了相应的解决方案； - Some parameters characterizing the action strength between the organic disulfide compounds and iron atom cluster, including the bonding strength, reactive strength, and static action strength, were analyzed using frontier electron density, super de-localizability, and net atomic charge as criteria.
以前线电子密度、超离域性指数和原子净电荷等参数作为表征有机二硫化物与金属作用强弱的判据，分析了有机二硫化物与铁原子间键合的强弱及反应性大小。 - Based on our earlier paper, the triple differential cross section for electron impact ionization atomic helium are calculated by use of Coulomb waves with an effective charge for the initial channel wave function.
在前期工作的基础上，当初通道使用具有有效电荷库仑波时，完成了电子入射离化氦原子三重微分截面的理论推导。 - It is an important way in QSAR/ QSPR study of organic chemicals that the parameters of molecular structure, such as Molecule Orbit Energy, Atomic Charge Density, Polarizability and Molecule Net Charge, are calculated in quantum chemistry method.
通过对化合物进行量子化学计算，可以获得有关分子的电子结构和立体结构信息，如分子轨道能、原子的电荷密度、极化率以及分子的静电荷等。 - Method for calculation of the atomic charge distribution in biomacromolecule
生物大分子中的原子等效电荷分布计算 - With consideration of the effects of atomic process, a simple code modeling the correction to poloidal charge-exchange recombination spectroscopy ( CXRS) measurement is developed.
考虑到原子过程的影响，对极向CXRS测量过程进行了数值模拟。 - The atomic arrangement at the plane of the interface is analyzed based on the image characteristics. Possible bonding configurations are discussed. The results suggest that interface formation is first driven by charge balance.
通过对界面原子排列的分析，界面化学键构型的讨论，结果表明电荷平衡原理是界面形成首要遵从的原则。 - The carbon atomic charge ( Qc) on C-O bond described the structural differences among the isomers of aliphatic alcohols and was easy to obtain.
容易获取，表征了醇分子同分异构体之间的结构差异。 - Study on Working Parameters of Atomic Emission Spectrometer with Axially Viewed Plasma and Charge Injection Detector
二维电荷注入检测器-端视等离子体光谱仪工作参数的研究