supported by the National Natural Science Foundation of China(21173172,21103143,21033006);the Research Fund for the Doctorial Program of Higher Education(20130121130001);the Program for Changjiang Scholars and Innovative Research Team in University(IRT1036)
The catalytic transformation of cellulose into key building-block or platform chemicals such as 5-hydoxymethylfurfural(HMF),levulinic acid,and lactic acid under mild conditions,has attracted much attention in recent y...
supported by the National Nature Science Foundation of China(21131005,20925103,21373167,21033006,21133004,21333008);the Fundamental Research Funds of Central Universities
Spin-polarized density functional theory (DPT) calculations are carried out to determine the site preference of H adsorption on Pd(100) surface and subsurface, We carefully scrutinize the energy difference between...
supported by the National Basic Research Program of China(2010CB732303,2013CB933102);the Major Project of Chinese Ministry of Education(309019);the National Natural Science Foundation of China(21033006,21073149,21273178);the Program for Changjiang Scholars and Innovative Research Team in University(IRT1036);the Ph.D Programs foundation of Chinese Ministry of Education(20110121110010)
CO oxidation was investigated on various powder oxide supported Pd catalysts by temperature-programined reaction. The pre-reduced catalysts show significantly higher activities than the pre-oxidized ones. Model studie...
supported by the National Basic Research Program of China (973 Program; 2010CB732303);the National Natural Science Foundation of China (21033006);the Program for Changjiang Scholars and Innovative Research Team in University (IRT1036)~~
ACKNOWLEDGMENTS This work was supported by the National Natural Science Foundation of China (No.21033006, No.21133004, and No.21373167) and the Ministry of Science and Technology (No.2010CB732303).
The electronic structure of the perovskite LaCoO3 at room temperature structure (293 K) was calculated by using PBE, PBE+U and HSE. Different spin configurations have been considered. Our calculations showed that t...
supported by the National Basic Research Program of China (2010CB732303);the National Natural Science Foundation of China (21173174, 20923004, 21033006, and 21161130522);the Program for Changjiang Scholars and Innovative Research Team in University (IRT1036)~~