Our official English website, www.x-mol.net, welcomes your
feedback! (Note: you will need to create a separate account there.)
How Equilibrium Gets Mimicked During Kinetic and Thermodynamic Control in Porphyrin and Phthalocyanine Self-Assembled Monolayers
Langmuir ( IF 3.7 ) Pub Date : 2017-11-20 00:00:00 , DOI: 10.1021/acs.langmuir.7b03320 Jeffrey R. Reimers 1, 2
Langmuir ( IF 3.7 ) Pub Date : 2017-11-20 00:00:00 , DOI: 10.1021/acs.langmuir.7b03320 Jeffrey R. Reimers 1, 2
Affiliation
|
The recent review of Hipps and Mazur is extended to consider the origins and significance of their conclusion that “surface structures vary with relative component concentration in a way that may mimic equilibria but is not”. How this situation can arise during self-assembly is discussed, as well as a range of qualitative and quantitative observations and high-level free-energy calculations that document the effect for meso-tetraalkylporphyrins self-assembled monolayer (SAM) polymorphs. This leads to a discussion of modern challenges facing quantification of the effects caused by kinetic control, as well as to the usefulness of equilibrium mimicking in the design and synthesis of SAMs.
中文翻译：
在卟啉和酞菁自组装单分子膜的动力学和热力学控制过程中如何模拟平衡
最近对Hipps和Mazur的评论扩展到考虑了其结论的起源和意义，即“表面结构随相对组分浓度而变化，其方式可能类似于平衡而并非如此”。如何这种情况能够出现在自组装所讨论的，以及一定范围的定性和定量的观测和高级别自由能计算该文件的作用内消旋-tetraalkylporphyrins自组装单层（SAM）多晶型物。这就引起了对由动力学控制引起的效应量化所面临的现代挑战的讨论，以及平衡模拟在SAMs设计和合成中的有用性。
更新日期：2017-11-21
中文翻译：
在卟啉和酞菁自组装单分子膜的动力学和热力学控制过程中如何模拟平衡
最近对Hipps和Mazur的评论扩展到考虑了其结论的起源和意义，即“表面结构随相对组分浓度而变化，其方式可能类似于平衡而并非如此”。如何这种情况能够出现在自组装所讨论的，以及一定范围的定性和定量的观测和高级别自由能计算该文件的作用内消旋-tetraalkylporphyrins自组装单层（SAM）多晶型物。这就引起了对由动力学控制引起的效应量化所面临的现代挑战的讨论，以及平衡模拟在SAMs设计和合成中的有用性。
京公网安备 11010802027423号