Optimizing the Spin States of Mesoporous Co3O4 Nanorods through Vanadium Doping for Long-Lasting and Flexible Rechargeable Zn–Air Batteries

ACS Catalysis ◽  
2021 ◽  
pp. 8097-8103
Author(s):  
Yuan Rao ◽  
Shan Chen ◽  
Qin Yue ◽  
Yijin Kang

1980 ◽  
Vol 41 (C10) ◽  
pp. C10-143-C10-154 ◽  
Author(s):  
A. Faessler




2020 ◽  
Author(s):  
Pierpaolo Morgante ◽  
Roberto Peverati

<div><div><div><p>In this Letter, we introduce a new database called carbon long bond 18 (CLB18), composed of 18 structures with one long C–C bond. We use this new database to evaluate the performance of several low-cost methods commonly used for geometry optimization of medium and large molecules. We found that the long bonds in CLB18 are electronically different from those found in barrier heights databases. We also report the unexpected correlation between the results of CLB18 and those of the energetics of spin states in transition-metal complexes. Given this unique property, CLB18 can be a useful tool for assessing existing electronic structure calculation methods and developing new ones.</p></div></div></div>



2021 ◽  
Vol 103 (10) ◽  
Author(s):  
Tharathep Plienbumrung ◽  
Maria Daghofer ◽  
Andrzej M. Oleś


1983 ◽  
Vol 27 (5) ◽  
pp. 2414-2416 ◽  
Author(s):  
W. Bauhoff ◽  
H. Schultheis ◽  
R. Schultheis


1987 ◽  
Vol 262 (22) ◽  
pp. 10524-10531 ◽  
Author(s):  
R J Kulmacz ◽  
A L Tsai ◽  
G Palmer


2021 ◽  
Vol 260 ◽  
pp. 124189
Author(s):  
Ahmed Azzouz-Rached ◽  
Habib Rached ◽  
Ismail Ouadha ◽  
Djamel Rached ◽  
Abderrahmane Reggad




2021 ◽  
Vol 64 (2) ◽  
Author(s):  
Jiying Zhang ◽  
Shan Wu ◽  
Yongchang Zhang ◽  
Zhengwei Zhou


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