Use the ZPE (zero point energy) , revise the whole energy.
对于单点能采用零点能校正。
A statistical expression of the late constant was raised, in which the zero point energy was considered, and the calculated results were in a good agreement with the experimental.
在考虑零点振动能后提出了一个速率常数的统计表达式,与实验结果符合很好。
The intermolecular interaction energy is calculated with MP2 electron correlation correction, basis set superposition error (BSSE) correction and zero point energy (ZPE) correction.
经MP2电子相关和基组叠加误差(BSSE)以及零点能(ZPE)校正,求得分子间相互作用能;
Scientists using this theory to trace our universe backward in time have found that its beginning point had a minimum volume that is not zero and a maximum energy that is not infinite.
科学家使用该理论追踪我们的早期宇宙,发现宇宙开始点拥有一个最小的体积,但是并不是零,一个最大的能量但不是无穷大。
It is the point at which particles have a minimum energy, determined by quantum mechanical effects, which is called the zero-point energy.
它指明了粒子有一个有量子机械作用而决定的能量最低值,我们将其称作为零点能。
I could have chosen my zero point of potential energy anywhere I please.
作为重力为0的点,我可以选择这里。
The potential energy surface with zero-point energy correction is drawn.
经过零点能校正后能位面被作了出来。
According to quantum theory, extracting the zero-point energy effectively and making it be impetus to micro-aircraft will help the micro aircraft to work without having to carry fuels.
依据量子理论,有效提取真空中的零点能,并以此作为驱动能源,可以解决微型飞行器由于必须携带燃料而增加重量等问题。
For dissociation energy, zero point vibration energy (ZPVE) is calculated and basis set superposition error (BSSE) is corrected by counterpoise method.
解离能计算进行了零点振动能(ZPVE)校正,并运用完全均衡校正法对基函数重叠误差(BSSE)进行校正。
For dissociation energy, zero point vibration energy (ZPVE) is calculated and basis set superposition error (BSSE) is corrected by counterpoise method.
解离能计算进行了零点振动能(ZPVE)校正,并运用完全均衡校正法对基函数重叠误差(BSSE)进行校正。
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