Traditional model for calculating performance parameters of a fix-pad journal bearing leads to heavy workload, complicated and changeable formulae as it requires deriving various geometric formulae with different bear...Traditional model for calculating performance parameters of a fix-pad journal bearing leads to heavy workload, complicated and changeable formulae as it requires deriving various geometric formulae with different bearing types such as circular journal bearing, dislocated bearing and elliptic bearing. Considering different pad preload ratios for non-standard bearing, traditional model not only becomes more complicated but also reduces scalability and promotion of the calculation programs. For the complexly case of traditional model while dealing with various fix-pad journal bearings, unified coordinate system model for performance calculation of fix-pad journal bearing is presented in the paper. A unified coordinate system with the bearing center at the origin is established, and the eccentricity ratio and attitude angle of axis relative to each pad are calculated through the coordinates of journal center and each pad center. Geometric description of fix-pad journal bearing is unified in this model, which can be used for both various standard bearing and non-standard bearing with different pad preload ratios. Validity of this model is verified with an elliptical bearing. Performance of a non-standard four-leaf bearing with different pad preload ratios is calculated based on this model. The calculation result shows that increasing preload ratio of the pad 1 and keeping that of the left three pads constant improves bearing capacity, stiffness and damping coefficients. This research presents a unified coordinate system model unifies performance calculation of fix-pad journal bearings and studied a non-standard four-leaf bearing with different pad preload ratios, the research conclusions provides new methods for performance calculation of fix-pad journal bearings.展开更多
The structure and energy of the carbonium ions formed upon protonation of butane were studied by the DFT methods. Four stable structures are identified for the protonated form of n-butane,the energy increases in the f...The structure and energy of the carbonium ions formed upon protonation of butane were studied by the DFT methods. Four stable structures are identified for the protonated form of n-butane,the energy increases in the following order:C2HC3<C1HC2<C2HH<C1HH,and the stability decreases in the following order C2HC3>C1HC2>C2HH>C1HH. The stability of the penta-coordinated carbonium ions may be explained by the electron distribution in the three-center-two-electron bonds. The delocalization of the penta-coordinated carbonium ion CHC with three-center-two-electron bonds on positive charges was stronger than that of the penta-coordinated carbonium ion CHH with three-center-two-electron bonds and its stability was higher than that of the penta-coordinated carbonium ion CHH with three-center-two-electron bonds.展开更多
We propose a novel binary image representation algorithm using the non-symmetry and anti-packing model and the coordinate encoding procedure （NAMCEP）. By tak- ing some idiomatic standard binary images in the field o...We propose a novel binary image representation algorithm using the non-symmetry and anti-packing model and the coordinate encoding procedure （NAMCEP）. By tak- ing some idiomatic standard binary images in the field of image processing as typical test objects, and by comparing our proposed NAMCEP representation with linear quadtree （LQT）, binary tree （Bintree）, non-symmetry and anti-packing model （NAM） with K-lines （NAMK）, and NAM representa- tions, we show that NAMCEP can not only reduce the aver- age node, but also simultaneously improve the average com- pression. We also present a novel NAMCEP-based algorithm for area calculation and show experimentally that our algo- rithm offers significant improvements.展开更多
Hydrogen evolution reaction(HER)has become a key factor affecting the cycling stability of aqueous Zn-ion batteries,while the corresponding fundamental issues involving HER are still unclear.Herein,the reaction mechan...Hydrogen evolution reaction(HER)has become a key factor affecting the cycling stability of aqueous Zn-ion batteries,while the corresponding fundamental issues involving HER are still unclear.Herein,the reaction mechanisms of HER on various crystalline surfaces have been investigated by first-principle calculations based on density functional theory.It is found that the Volmer step is the ratelimiting step of HER on the Zn(002)and(100)surfaces,while,the reaction rates of HER on the Zn(101),(102)and(103)surfaces are determined by the Tafel step.Moreover,the correlation between HER activity and the generalized coordination number(CN)of Zn at the surfaces has been revealed.The relatively weaker HER activity on Zn(002)surface can be attributed to the higher CN of surface Zn atom.The atomically uneven Zn(002)surface shows significantly higher HER activity than the flat Zn(002)surface as the CN of the surface Zn atom is lowered.The CN of surface Zn atom is proposed as a key descriptor of HER activity.Tuning the CN of surface Zn atom would be a vital strategy to inhibit HER on the Zn anode surface based on the presented theoretical studies.Furthermore,this work provides a theoretical basis for the in-depth understanding of HER on the Zn surface.展开更多
基金Supported by National Natural Science Foundation of China(Grant No.51275395)Major National Basic Research Development Program of China(973 Program,Grant Nos.2009CB724304-2,2009CB724404)
文摘Traditional model for calculating performance parameters of a fix-pad journal bearing leads to heavy workload, complicated and changeable formulae as it requires deriving various geometric formulae with different bearing types such as circular journal bearing, dislocated bearing and elliptic bearing. Considering different pad preload ratios for non-standard bearing, traditional model not only becomes more complicated but also reduces scalability and promotion of the calculation programs. For the complexly case of traditional model while dealing with various fix-pad journal bearings, unified coordinate system model for performance calculation of fix-pad journal bearing is presented in the paper. A unified coordinate system with the bearing center at the origin is established, and the eccentricity ratio and attitude angle of axis relative to each pad are calculated through the coordinates of journal center and each pad center. Geometric description of fix-pad journal bearing is unified in this model, which can be used for both various standard bearing and non-standard bearing with different pad preload ratios. Validity of this model is verified with an elliptical bearing. Performance of a non-standard four-leaf bearing with different pad preload ratios is calculated based on this model. The calculation result shows that increasing preload ratio of the pad 1 and keeping that of the left three pads constant improves bearing capacity, stiffness and damping coefficients. This research presents a unified coordinate system model unifies performance calculation of fix-pad journal bearings and studied a non-standard four-leaf bearing with different pad preload ratios, the research conclusions provides new methods for performance calculation of fix-pad journal bearings.
文摘The structure and energy of the carbonium ions formed upon protonation of butane were studied by the DFT methods. Four stable structures are identified for the protonated form of n-butane,the energy increases in the following order:C2HC3<C1HC2<C2HH<C1HH,and the stability decreases in the following order C2HC3>C1HC2>C2HH>C1HH. The stability of the penta-coordinated carbonium ions may be explained by the electron distribution in the three-center-two-electron bonds. The delocalization of the penta-coordinated carbonium ion CHC with three-center-two-electron bonds on positive charges was stronger than that of the penta-coordinated carbonium ion CHH with three-center-two-electron bonds and its stability was higher than that of the penta-coordinated carbonium ion CHH with three-center-two-electron bonds.
基金We thank the anonymous reviewers and editors for their valuable comments on improving this paper. This work was supported by the National Natural Science Foundation of China （Grant No. 61300134）, the Research Fund for the Doctoral Program of Higher Education of China （20120172120036）, the Natural Science Foundation of Guangdong Province of China （S2011040005815 and S2013010012515）, the Foundation for Dis- tinguished Young Talents in Higher Education of Guangdong of China （LYM11015）, and the Fundamental Research Funds for the Central Universities of China （2011ZM0074 and 2013ZZ0050）.
文摘We propose a novel binary image representation algorithm using the non-symmetry and anti-packing model and the coordinate encoding procedure （NAMCEP）. By tak- ing some idiomatic standard binary images in the field of image processing as typical test objects, and by comparing our proposed NAMCEP representation with linear quadtree （LQT）, binary tree （Bintree）, non-symmetry and anti-packing model （NAM） with K-lines （NAMK）, and NAM representa- tions, we show that NAMCEP can not only reduce the aver- age node, but also simultaneously improve the average com- pression. We also present a novel NAMCEP-based algorithm for area calculation and show experimentally that our algo- rithm offers significant improvements.
基金This work was financially supported by the National Natural Science Foundation of China(22075171)Natural Science Foundation of Shanghai(23ZR1423400)The firstprinciples calculations were supported by the High Performance Computing Center of Shanghai University.
文摘Hydrogen evolution reaction(HER)has become a key factor affecting the cycling stability of aqueous Zn-ion batteries,while the corresponding fundamental issues involving HER are still unclear.Herein,the reaction mechanisms of HER on various crystalline surfaces have been investigated by first-principle calculations based on density functional theory.It is found that the Volmer step is the ratelimiting step of HER on the Zn(002)and(100)surfaces,while,the reaction rates of HER on the Zn(101),(102)and(103)surfaces are determined by the Tafel step.Moreover,the correlation between HER activity and the generalized coordination number(CN)of Zn at the surfaces has been revealed.The relatively weaker HER activity on Zn(002)surface can be attributed to the higher CN of surface Zn atom.The atomically uneven Zn(002)surface shows significantly higher HER activity than the flat Zn(002)surface as the CN of the surface Zn atom is lowered.The CN of surface Zn atom is proposed as a key descriptor of HER activity.Tuning the CN of surface Zn atom would be a vital strategy to inhibit HER on the Zn anode surface based on the presented theoretical studies.Furthermore,this work provides a theoretical basis for the in-depth understanding of HER on the Zn surface.
