体密度

The interaction of two NO molecules and NO dimers with Cu2 has been studied at B3LYP/Lanl2DZ level.

采用密度泛函理论中的B3LYP方法，在Lan12DZ基组下，对NO双分子和二聚体与铜原子簇相互作用的结构进行了研究。

The -300V and -500V electrets were applied on 3T3 cells for 24 and 48h, respectively, then the surface charge density on 3T3 cells and the intracellular free Ca2+ concentration and the number of apoptosis were measured by means of cell electrophoresis and flow cytometry method, respectively.

利用Fluo—3/AM Ca2+指示剂，采用流式细胞术测定3T3细胞内钙离子浓度的变化和3T3细胞的凋亡量，探讨驻极体诱导3T3细胞凋亡与细胞表面电荷密度和游离钙浓度变化之间的关系。

Some key issues on crystal growth, such as feed rod, growth rate and annealing process, have been discussed.

结果表明，原料棒的直径、均匀性和致密度直接影响晶体生长过程中熔体的稳定性，从而影响晶体的质量。

As the effect of pressure decreased in the quick exhumation episode of UHPM rocks, and such changes after trapping as necking_down and explosion occurred in varying degrees in fluid inclusions of all events, the present densities of the fluid inclusions mostly do not reflect the state of the trapping, and their isochores are not suitable for the estimation of trapping temperatures and pressures.

由于超高压变质岩系的快速折返抬升造成的压力迅速降低等影响，各个事件中形成的流体包裹体都发生了程度不同的颈缩及爆裂等捕获后变化，其密度大都已不能反映捕获时的状态。

The influence of ligand and cooperative metal on carbonyl insertion in heterobimetallic Rh-M species was investigated at the B3LYP level of density functional theory.

采用密度泛函方法研究了配体和协同金属对杂双核Rh-M金属配合物中羰基插入反应的影响。

In a non-breeding, high density population of great gerbil we studied the dependence of stress and sex hormone concentrations, size of the mid-ventral gland and body mass of young males on presence of adult gerbils (≥1 year old) in social groups.

在非繁殖期高密度大沙鼠种群中，我们研究了胁迫以及幼年雄鼠的性激素浓度、腹中腺大小和体重对社群中成体(≥1年龄)存在的依赖性。

The structures of menoquinone MQ1, ubiquinone UQ1 and their radical anions are optimized by both the semiempirical AM1 and density functional theory [B3LYP/6-31G] methods.

用量子化学半经验的AM1和密度泛函DFTBELYP/6-31G(d方法分别优化了质体醌MQ1、泛醌UQ1及其阳离子自由基的结构。

The five prosthetic groups (FAD, [2Fe-2S], [4Fe-4S], [3Fe-4S] and heme group) required for electron transfer from succinate to ubiquinone were unambiguously assigned into the electron density map. Besides, we find there are some electron densities around the Qp pocket at the matrix side and we believe it represents the head structure of ubiquinone, which is proved by the inhibitor bound structure that 2-TTFA just locating at the Qp site. At the same time, we find there is the second 2-TTFA binding site, locating the inter-membrane side. This finding will change our knowledge about the electron transfer inside Complex II and the ubiquinone transfer between Complex II and Complex III, and endow a new role of Complex II in electron transfer chain.

除了对各个电子传递体（ FAD ，[2Fe-2S]，[4Fe-4S]，[3Fe-4S]以及血红素分子）进行精确定位外，我们在该结构跨膜区靠近线粒体基质一端的口袋 Qp 中，发现了一些电子密度，认为是所结合的辅酶 Q 的头部结构，这一点被与抑制剂结合的复合体的结构所证明，在该结构中， 2－ TTFA 恰好结合在口袋 Qp 中，同时，我们还发现了第二个2－ TTFA 的结合位点，位于跨膜区靠近线粒体膜间隙一端的口袋 Qd 中，这个发现具有全新的意义，将影响人们对电子在复合物 II 中传递以及辅酶 Q 在复合物 II 与 III 之间转移的认识，促使人们重新复合物 II 在线粒体呼吸链中的角色。

Based on density functional theory and electronegativity equalization principle,applying an atom-bond electronegativity equalization σπ model,using a separated program,we calculated the charge distributions and dipole moments of guanine tautomers.

以密度泛函和电负性均衡原理为基础发展的原子-键电负性均衡方法的σπ模型。并结合自编程序，计算了鸟嘌呤五种异构体的电荷分布和偶极矩，计算结果表明，所计算出的电荷分布可以和从头算结果很好地关联。所计算的偶极矩与其它从头计算方法和力场方法相比总体趋势相同，进一步说明了ABEEMσπ模型的合理性

These anti-christ souls or schisms have often traveled down the dimensions in their forgetfulness, looking for a home.

在遗忘中，这些反基督灵魂或分裂体们经常沿密度旅行，寻找他们的家。

With Death guitarist Schuldiner adopting vocal duties, the band made a major impact on the scene.

随着死亡的吉他手Schuldiner接受主唱的职务，乐队在现实中树立了重要的影响。

But he could still end up breakfasting on Swiss-government issue muesli because all six are accused of nicking around 45 million pounds they should have paid to FIFA.

不过他最后仍有可能沦为瑞士政府&议事餐桌&上的一道早餐，因为这所有六个人都被指控把本应支付给国际足联的大约4500万英镑骗了个精光。