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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。

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。

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。

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。

" This is the very proud thing, but it was the self-confidence and dare not confident that this is some of the people in your unrequited love, and here I must note in advance, rather than what I am talking about, but they say --- Director Stephenson said:"In fact, Jackie Chan, Jet Li, Bruce Lee's martial arts we have a reference, including Stephen Chow ...

这本该是很值得骄傲的事,但总有人该自信时不敢自信,认为这又是某些国人在自作多情,这里我得事先说明,话不是我说的,而是他们自己说的——导演史蒂芬森说:&其实,成龙、李连杰、李小龙的功夫我们都参考了,甚至包括周星驰……&本片另一位导演马克?

The triple way may appear to be altogether mental and spiritual in its way of seeking and its objectives, but it can be attended by results more characteristic of the other paths, which offer themselves in a spontaneous and involuntary flowering, and for the same reason, because soul-power is all-power and where it reaches its height in one direction its other possibilities also begin to show themselves in fact or in incipient potentiality.

三一之道在其寻求的方式和目标上,可能好象是全然心思底和精神底,但也可能附生其结果更特著属于他道的,那是在一种自发底不意底华发中,不求自得,而且,为了同一理由,因为心灵权能便是大全权能,而且在某一方向它已达到其高境了,其余的可能性也开始在事实上,或在萌蘖底潜能性上,自家呈献。

Since we are all told that there are always at least one worm in an apple, the one believing it would be very careful. With careful biting his chance to see one whole worm is higher than half.

既然我们已经知道所有的苹果里都至少有一个虫子,相信的人自会非常小心,小心得去吃苹果,那么他看到整条虫的机会就大得多。

The traditional English meal(lunch or dinner,lunch generally being the lighter meal) is based on plain,simply-cooked food.British beefsteak is unsurpassed(with the best steaks coming from the Scotch Angus cattle)and is accompanied by roast potatoes;a second vegetable,and Yorkshire pudding(baked batter,a mixture of flour,egg,milk and salt).

一顿传统的英国正餐(午餐或是晚餐,通常来讲晚餐会更丰盛些),食物通常都简单易做:一道英式牛排,举世无双(其牛排取自苏格兰安格斯牛,品质一流),伴以烤土豆;第二道菜为蔬菜,然后是约克郡布丁(将面粉、鸡蛋、牛奶和盐混合搅拌,焙烤而得)。

Here "cool" everybody said by no means masculine that kind of cool, was not said that you put on any ultra short jeans to reveal the great size thigh, put on any low shorts to expose the contented navel, wore any suspenders trousers saying that you had card ha Iraq how, wore any bell-bottomed trousers to explain that you had the maturity, wore any black flower bud silk trousers implication sexy index to have high, and so on like this "cool".

这里的&酷&并非大家所说的男性那种的酷,更不是说你穿了什么超短牛仔裤露了多大尺寸的大腿,穿了什么低腰裤展露自得的肚脐,着了什么吊带裤说你有多么的卡哇伊,着了什么喇叭裤说明你有成熟,着了什么黑色蕾丝裤寓意性感指数有多高,等等如此的&酷&。

Now the memory can't hold that there is an error and with the hitting things get better: got it from: Re: Re: Re: Self Diagnosis C:31:22 Jim - 16th Jan 2005 9:33 If not they follow the above steps again except they disassemble the case and blow it out.

现在内存不能认为是一个错误,并与创事情变得更好:你来自:回复:回复:回复:自诊断三: 31:22吉姆-2 005年1月1 6日9时3 3分如果他们不遵守上述步骤再次除拆开的情况,并打击了。

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The split between the two groups can hardly be papered over.

这两个团体间的分歧难以掩饰。

This approach not only encourages a greater number of responses, but minimizes the likelihood of stale groupthink.

这种做法不仅鼓励了更多的反应,而且减少跟风的可能性。

The new PS20 solar power tower collected sunlight through mirrors known as "heliostats" to produce steam that is converted into electricity by a turbine in Sanlucar la Mayor, Spain, Wednesday.

聚光:照片上是建在西班牙桑路卡拉马尤城的一座新型PS20塔式太阳能电站。被称为&日光反射装置&的镜子将太阳光反射到主塔,然后用聚集的热量产生蒸汽进而通过涡轮机转化为电力