lyp

High-pressure induced 1,3-dipolar cycloadditions of azides with both electron-deficient and electron-rich olefins are studied.

在B3LYP/6-31G水平上对高压诱导的叠氮化合物与缺电子烯烃以及富电子烯烃间的1,3-偶极环加成反应进行了研究。

The URL for the Lonely Planet travel centre is http://www.lonelyplanet.com.

“孤独星球旅游中心”的网址是http：//www.lonelyplanet.com。

One endophytic stain SS 02 was isolated from the underground stems of Paris polyphylla var. Chinensis franch.

从华重楼(Parispolyphyllavar·ChinensisFranch)的地下块茎中分离到一株内生细菌(SS02),试验表明其发酵液对13种作物致病菌的生长有抑制作用.

Methods Density functional ( B3LYP) method with Relativistic Effective Core Potential ( RECP) has been used to optimize the structures of PdH and PdH_2 molecules.

方法采用数用相对论有效原子实势（RECP）和密度泛函（B3LYP）方法。

Polyphenol Oxidase ( PPO ) is not only related to anti-disease of potato, but also related to browning potato tuber.

多酚氧化酶 ( PolyphenolOxidase,PPO ) 不仅与马铃薯抗病性有关, 也与马铃薯块茎损伤褐化有关.

The results show that the process of herbaceous vegetation restoration can be divide into the following stages obviously: Capsella bursa-pastoris+ Acalypha australis+ Conyza canadensis community ( 1 year abandoned);

结果表明，草本植被恢复演替过程可明显分为以下几个阶段：荠菜（Capsella bursa-pastoris）+铁苋菜（Acalypha australis）+小白酒草（Conyza canadensis）群落（退耕1年）；

In addition to open source offerings at the hypervisor level, Eucalyptus, OpenStack and OpenNebula provide additional support for building and managing private clouds.

不仅如此，开源社区还在管理层上额外提供了私有云构建和管理支持，例如Eucalyptus，OpenStack和OpenNebula。

Former Peace Corps volunteer Jeff Rose heads the Full Belly Project.

前和平军团的志愿者杰佛·罗斯担任theFullBellyProject的领导.

Objective To investigate the surgical treatment of familial adenomatous polyposis ( FAP ).

目的　探讨家族性腺瘤样息肉病 ( familialadenomatouspolyposis, FAP ) 的外科治疗.

Charge transfer was discussed at the equilibrium geometry. The relation between the maximum stabilization energies and charge transfer is analyzed. The electron transfer matrix element Vrp was calculated by the Koopmans' theorem at the DFT/ B3LYP level of theory.

通过改变两苯环间距获得不同体系的能量和平衡几何构型，分析了最大稳定化能和电荷转移的关系，用Koopmans理论在B3LYP/6-31G水平计算了电子转移矩阵元Vrp。

Density functional ( B3LYP/ SDD) method with Relativistic Effective Core Potential ( RECP) is used to optimize the molecular structures of PdO_2 and YO_2 in Gaussian 98 program.

在相对论有效原子实势（RECP）近似下，用密度泛函（B3LYP/SDD）方法计算得到了PdO2和YO2分子的结构参数和光谱性质。