A DFT study on the absorption mechanism of vinyl chloride by ionic liquids

2016 ◽  
Vol 215 ◽  
pp. 496-502 ◽  
Author(s):  
Haitao Sun ◽  
Bobo Cao ◽  
Qingqing Tian ◽  
Shuangyue Liu ◽  
Dongmei Du ◽  
...  
Keyword(s):  
Ionic Liquids ◽  
Vinyl Chloride ◽  
Dft Study ◽  
Absorption Mechanism

DFT Study on the Chemical Absorption Mechanism of CO2 in Diamino Protic Ionic Liquids

2021 ◽  
Vol 125 (5) ◽  
pp. 1416-1428
Author(s):  
Jing Ma ◽  
Yutong Wang ◽  
Xueqing Yang ◽  
Mingxuan Zhu ◽  
Baohe Wang
Keyword(s):  
Ionic Liquids ◽  
Dft Study ◽  
Protic Ionic Liquids ◽  
Absorption Mechanism ◽  
Chemical Absorption

Effect of the Side-Chain Length and NLO Properties of the N-ethyl-N,N,N-trialkylammonium Ionic Liquids – A DFT Study

2021 ◽  
pp. 116251
Author(s):  
M.A. Olea-Amezcua ◽  
J.E. Castellanos-Águila ◽  
H. HernÁndez-Cocoletzi ◽  
E. Ferreira ◽  
M. Trejo-Durán ◽  
...  
Keyword(s):  
Ionic Liquids ◽  
Chain Length ◽  
Dft Study ◽  
Side Chain ◽  
Side Chain Length ◽  
Nlo Properties

An absorption mechanism and polarity-induced viscosity model for CO2 capture using hydroxypyridine-based ionic liquids

2017 ◽  
Vol 19 (2) ◽  
pp. 1134-1142 ◽  
Author(s):  
Xiaowei An ◽  
Xiao Du ◽  
Donghong Duan ◽  
Lijuan Shi ◽  
Xiaogang Hao ◽  
...  
Keyword(s):  
Ionic Liquids ◽  
Co2 Capture ◽  
Viscosity Model ◽  
Absorption Mechanism ◽  
Chemical Absorption

A series of new hydroxypyridine-based ionic liquids (ILs) are synthesized and applied in CO2 capture through chemical absorption.

Vibrational spectroscopy of imidazolium-based ionic liquids: A combined MD/DFT study

2019 ◽  
Vol 292 ◽  
pp. 111282 ◽  
Author(s):  
Jiannan Liu ◽  
Hyunjin Kim ◽  
Nilesh R. Dhumal ◽  
Hyung J. Kim
Keyword(s):  
Ionic Liquids ◽  
Vibrational Spectroscopy ◽  
Dft Study

scholarly journals The electronic structure of ionic liquids based on the TFSI anion: A gas phase UPS and DFT study

2019 ◽  
Vol 294 ◽  
pp. 111580 ◽  
Author(s):  
Ivar Kuusik ◽  
Mati Kook ◽  
Rainer Pärna ◽  
Antti Kivimäki ◽  
Tanel Käämbre ◽  
...  
Keyword(s):  
Electronic Structure ◽  
Ionic Liquids ◽  
Gas Phase ◽  
Dft Study

scholarly journals A DFT study on lignin dissolution in imidazolium-based ionic liquids

RSC Advances ◽  
2017 ◽  
Vol 7 (21) ◽  
pp. 12670-12681 ◽  
Author(s):  
Yaqin Zhang ◽  
Hongyan He ◽  
Kun Dong ◽  
Maohong Fan ◽  
Suojiang Zhang
Keyword(s):  
Ionic Liquids ◽  
Dft Study ◽  
Π Stacking

Co-interaction lead to dissolution of lignin in ILs: H-bonds and π–π stacking.

Absorption of Vinyl Chloride by Room Temperature Ionic Liquids

2009 ◽  
Vol 37 (3) ◽  
pp. 245-248 ◽  
Author(s):  
Xuepei Cheng ◽  
Guanying Yang ◽  
Tiancheng Mu ◽  
Xiangkun Guo ◽  
Xiaoling Wang
Keyword(s):  
Ionic Liquids ◽  
Vinyl Chloride ◽  
Room Temperature ◽  
Room Temperature Ionic Liquids
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