Quantum Modeling and Classical Simulations of Hydrogen-Bonded Oligomers: New Candidates for Proton Conduction

2020 ◽  
Vol 44 (19) ◽  
pp. 8098-8105 ◽  
Author(s):  
Qingxu Wang ◽  
Zhejun Ye ◽  
Guoqing Shi ◽  
Kaimeng Guo ◽  
Gang Li

At 98% RH and 100 °C, two dimer-based HSFs show the best σ values of 3.13 × 10−4 S cm−1 for 1 and 0.55 × 10−4 S cm−1 for 2, which can be compared to the values of reported HSFs.


2016 ◽  
Vol 16 (10) ◽  
pp. 5831-5835 ◽  
Author(s):  
Wei Yang ◽  
Fan Yang ◽  
Tong-Liang Hu ◽  
Stephen Charles King ◽  
Hailong Wang ◽  
...  

2020 ◽  
Vol 44 (25) ◽  
pp. 10562-10568 ◽  
Author(s):  
Zhi-Qiang Shi ◽  
Ning-Ning Ji ◽  
Wan-Yao Chen ◽  
Gang Li

Two hydrogen-bonded supramolecular lanthanide complexes based on imidazole dicarboxylate show different proton conductivities.


1980 ◽  
Vol 46 (1-2) ◽  
pp. 215-229 ◽  
Author(s):  
E.-W. Knapp ◽  
K. Schulten ◽  
Z. Schulten

2017 ◽  
Vol 46 (21) ◽  
pp. 6968-6974 ◽  
Author(s):  
Sakharam B. Tayade ◽  
Vishal M. Dhavale ◽  
Avinash S. Kumbhar ◽  
Sreekumar Kurungot ◽  
Peter Lönnecke ◽  
...  

Bipyridine glycoluril (BPG) forms a square-pyramidal secondary building unit with copper(ii) which further self-assembles to give a porous hydrogen-bonded complex with high proton conductivity.


2019 ◽  
Vol 43 (26) ◽  
pp. 10637-10644 ◽  
Author(s):  
Zhi-Bing Sun ◽  
Yi-Lin Li ◽  
Zhe-Hua Zhang ◽  
Zi-Feng Li ◽  
Bo Xiao ◽  
...  

The proton conduction in one HOF and related MOF have been investigated and discussed.


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