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- Abstract : The bimolecular single collision reaction potential energy surface of an isocyanate NCO radical with a ketene CH2CO molecule was investigated by means of B3LYP and QCISD(T) methods. 摘要 ： 采用B3LYP和QCISD(T)方法計算得到了NCO自由基與乙烯酮(CH2CO)雙分子單碰撞反應勢能面。
- Theoretical Studies on Reaction Potential Energy Surface of the Formyl Radical with Nitrogen Dioxide 孫揚,孫延波,黃旭日, 順-8-三甲基錫烷基-6-辛烯醛分子內環(huán)化反應立體選擇性的理論研究
- Potential energy is convertible to kinetic energy. 勢能可轉化為動(dòng)能。
- The zero of potential energy is arbitrary. 零勢能的定義是任意的。
- In the circumstances the potential energy turns to kinetic energy. 在這種情況下，勢位能就轉化成動(dòng)能。
- What are the maximum potential energy and the total energy? 最大勢能和總能量是多少?
- Equation expresses the principle of minimum potential energy. 方程表示出最小勢能原理。
- Why the Potential Energy Belongs to the Matter System? 勢能為什么是一個(gè)物體系所共有的?
- The air flows down to a shaft and thus loses potential energy. 空氣向下進(jìn)入豎井，因而失去勢能。
- We can therefore say that the system has internal potential energy. 因此，我們可以說(shuō)，該系統有內勢能。
- An ab initio potential energy surface of He-LiH complex[J]. 引用該論文 黃武英;鳳爾銀;季學(xué)韓;崔執鳳.
- The outline of the molecular reaction dynamics and stereodynamics, together potential energy surface (PES) of reaction systems are given in introduction section. 本論文的引言部分簡(jiǎn)要介紹了分子反應動(dòng)力學(xué)以及立體動(dòng)態(tài)學(xué)的發(fā)展和研究現狀，同時(shí)介紹了勢能面的知識。
- For the reason that potential energy curve can not be overlapped the enantiotropy reaction of fulgides in the ground state was infeasible and fulgides were thermostable. 在第一單重激發(fā)態(tài) ,有利于發(fā)生開(kāi)環(huán)反應 ;
- In this MCAI course ware, the potential energy surface of a bimolecular reaction system that is composed of three atoms has been described figuratively. 在此課件中，一個(gè)由三原子組成的雙分子反應體系的位能面被形象地表達出來(lái)。
- At the level of CCSD(T)//B3LYP adding the high class calculation-G3//B3LYP and G3//MP2, the potential energy surfaces (PES) of the HCO/HOC+C2H2 reaction are investigated detailed. 2．在CCSD(T)//B3LYP水平上，結合更高精度的G3//B3LYP和G3//MP2計算，詳細地研究了乙炔與HCO/HOC自由基的反應勢能面。
- We seem to be considering chemical bonding solely in terms of potential energy. 我們似乎只用勢能來(lái)考慮化學(xué)成鍵。
- It is the distance between atoms corresponding to zero potential energy. 這就是相應于勢能為零時(shí)的原子間距。
- Kinetic energy and theorem of kinetic energy; law of potential energy. 動(dòng)能和動(dòng)能定理;勢能定理。
- Electric potential is the potential energy of electrons at a certain point. 電勢表示的是電子在某點(diǎn)的勢能。
- Structures and potential energy functions of PdH and PdH2 molecule[J]. 引用該論文 倪羽;蔣剛;毛華平;朱正和;王紅艷.
