On the definition of the microcanonical temperature of small weakly bound molecular clusters

Belega E.D.; Cheremukhin E.A.; Elyutin P.V.; Trubnikov D.N.

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On the definition of the microcanonical temperature of small weakly bound molecular clusters

机译：关于弱弱结合分子簇的微规范温度的定义

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The concept of the microcanonical temperature for weakly bound clusters is re-examined. A parameter defined as the number of effective modes is suggested as a measure of complexity of distribution of the internal energy between the collective modes of a cluster. The water pentamer is considered as an example. The temperature regions for solid-like and liquid-like phases are obtained and the typical collective motions of the water molecules are estimated for each phase.

机译：重新审查了弱绑定簇的微经典温度的概念。建议使用定义为有效模式数的参数来衡量群集的集体模式之间内部能量分布的复杂性。以水五聚体为例。获得了固态和液态相的温度区域，并估计了每个相的水分子的典型集体运动。

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《Chemical Physics Letters》 |2010年第3期|共5页
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Belega E.D.; Cheremukhin E.A.; Elyutin P.V.; Trubnikov D.N.;
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1. On the definition of the microcanonical temperature of small weakly bound molecular clusters [J] . Belega E.D., Cheremukhin E.A., Elyutin P.V., Chemical Physics Letters . 2010,第1a3期

机译：关于弱弱结合分子簇的微规范温度的定义
2. Least-squares mass-dependence molecular structures for selected weakly bound intermolecular clusters [J] . Kisiel Z. Journal of Molecular Spectroscopy . 2003,第1期

机译：所选的弱结合分子间簇的最小二乘质量依赖性分子结构
3. Vibrational quenching and reactive processes of weakly bound molecular ions colliding with atoms at cold temperatures [J] . Physical Review, A . 2019,第2aPta1期

机译：浊猝灭与浊度分子离子在寒冷温度下与原子碰撞的反应过程
4. Cationic polymerizations at elevated temperatures by novel initiating systems having weakly coordinating counteranions. 1. high molecular welght polyisobutylenes [C] . Z.Pi, S.Jacob, J.P.Kennedy, NATO advanced study institute on ionic polymerizations and related processes . 1999

机译：通过新的引发系统在具有弱协调的抗衡的升高温度下阳离子聚合。 1.高分子Welght聚异丁烯
5. ROTATIONAL SPECTROSCOPY OF WEAKLY-BOUND COMPLEXES UTILIZING A HIGH-TEMPERATURE MOLECULAR SOURCE (MICROWAVE). [D] . SHEA, JAMES ARTHUR. 1984

机译：利用高温分子源（微波）的弱结合复合物的旋转光谱。
6. Trigonal Mn3 and Co3 Clusters Supported by Weak-Field Ligands: A Structural Spectroscopic Magnetic and Computational Investigation into the Correlation of Molecular and Electronic Structure [O] . Alison R. Fout, Dianne J. Xiao, Qinliang Zhao, -1

机译：由弱场配体支持的三角形MN3和CO3簇：分子和电子结构相关的结构光谱磁性和计算研究
7. Vibrational quenching and reactive processes of weakly bound molecular ions colliding with atoms at cold temperatures [O] . Jesús Pérez-Ríos 2019

机译：浊猝灭与浊度分子离子在寒冷温度下与原子碰撞的反应过程
8. Intermolecular potential functions and high resolution molecular spectroscopy of weakly bound complexes. Final progress report [R] . Muenter, J. S. 1997

机译：弱结合复合物的分子间势函数和高分子量分子光谱。最终进度报告

On the definition of the microcanonical temperature of small weakly bound molecular clusters

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