分子动力学模拟研究[Bmim][PF6]+ 水+ 醇三元体系的微观结构和分子间相互作用

梅清清, 侯民强, 宁汇, 马珺, 杨德重, 韩布兴 - 物理化学学报, 2014 - whxb.pku.edu.cn
… to solvation energies using the Abraham solvation parameter … In this work, we studied
the mircostructures and … Our literature survey indicated that theoretical study has not been …

[HTML][HTML] 低维纳米受限离子液体的研究进展

王琛璐, 王艳磊, 赵秋, 吕玉苗, 霍锋, 何宏艳 - 化工学报, 2021 - hgxb.cip.com.cn
research progress of LD nanoconfined ionic liquids, the experimental and theoretical methods
suitable for LD nanoconfined ionic … the interface between an imidazolium ionic liquid and …

高压锂电池正极电解质界面研究进展

刘建东, 张志佳, 马建民 - 物理化学学报, 2023 - whxb.pku.edu.cn
… and ions leads to a potential gradient at the interface between the … theoretical analysis. The
main methods for morphological … simulations enable the study of the Li+ solvation structure in …

[HTML][HTML] 饱和蒙脱土高压力学特性基本机制多尺度研究

况联飞, 首先, 其次, 再次, 最后, 基于微 - 2013 - cgl.org.cn
… of the interlayer water issignificantly higher than free water, and ion hydrationhydration
repulsion, we modify thetraditional Gouy-Chapman diffusion double layer theory and analysis

硫粉为硫源, 多元醇辅助合成硫化钼纳米片

王辉, 邹德春 - 物理化学学报, 2017 - whxb.pku.edu.cn
… by both experimental and theoretical studies, are limited to the … The interaction and hydration
of lithium cations combined with … floated on the interface of the mixture of water and EG. At …

限域传递机制初探: 以限域状态为切入点描述传递阻力

覃瑶, 张禹萌, 潘雪玲, 王文强, 戴正兴, 朱育丹… - 化工学报, 2023 - hgxb.cip.com.cn
… transfer theory. The lack of the transfer theory oriented to the limit can no longer meet the
needs of the development of modern industry. This paper summarizes the research work of our …

[HTML][HTML] 离子液体的溶液热力学模型研究进展

李春喜 - 化工学报, 2020 - hgxb.cip.com.cn
: 离子液体是近年来发展起来的一种绿色介质, 在化工反应和分离过程中具有广泛的应用前景. 离子
液体的溶液热力学性质和相平衡数据是其相关工艺过程设计的基础. 本文从如下几个方面综述…

[HTML][HTML] 离子液体在生物质溶解分离中的应用与机理研究

赵金政, 周国辉, 刘晓敏 - 化工学报, 2021 - hgxb.cip.com.cn
… The role of the cation in the solvation of cellulose by imidazolium-based ionic liquids[J]. Journal
… Density functional theory investigations on the structure and dissolution mechanisms for …

功能性聚丙二醇-二腺嘌呤奈米顆粒性質研究

李舜傑 - 2016 - tdr.lib.ntu.edu.tw
… Table 4-2 Theoretical atomic compositions of the reactant … into water, the water molecules
will reorganize to solvate the … the creation of solvent-solute interface, depending on the polarity …

离子固化剂改性蒙脱土吸附水特性及持水模型研究

黄伟, 刘清秉, 项伟, 张云龙, 王臻华 - 岩土工程学报, 2019 - cgejournal.com
… with water molecules to form monolayer of hydration shell at … <0.45~0.5, followed by hydration
on basal surface of crystal … A review on recent developments in soil water retention theory