OD

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Novel potential energy surface-based quantum dynamics of ion–molecule reaction O^++ D_2→OD^++ D
《Chinese Physics B》2018年第4期276-280,共5页Xian-Long Wang Feng Gao Shou-Bao Gao Lu-Lu Zhang Yu-Zhi Song Qing-Tian Meng 
Project supported by the National Natural Science Foundation of China(Grant Nos.11674198 and 11304185)
According to a novel electronic ground-state potential energy surface of H2O^＋（X^4 A″）,we calculate the reaction probabilities and the integral cross section for the titled reaction O^＋＋ D2→OD^＋＋ D by the Che...
关键词：quantum dynamics Chebyshev wave packet propagation O^＋ ＋ D2 
Experimental optimum design and luminescence properties of NaY(Gd)(MoO_4)_2:Er^(3+)phosphors
《Chinese Physics B》2016年第6期201-205,共5页孙佳石 徐赛 李树伟 石琳琳 翟梓会 陈宝玖 
Project supported by Education Reform Fund of Dalian Maritime University,China(Grant No.2015Y37);the Natural Science Foundation of Liaoning Province,China(Grant Nos.2015020190 and 2014025010);the Open Fund of the State Key Laboratory on Integrated Optoelectronics,China(Grant No.IOSKL2015KF27);the Fundamental Research Funds for the Central Universities,China(Grant No.3132016121)
Three-factor orthogonal design（OD） of Er3＋/Gd3＋/T（calcination temperature） is used to optimize the luminescent intensity of Na Y（Gd）（MoO4）2：Er3＋phosphor.Firstly,the uniform design（UD） is introduced to ex...
关键词：orthogonal design（OD） uniform design（UD） NaY（Gd）（MoO4）2 Er3＋ luminescent intensity 
Theoretical study of stereodynamics for the N+H_2/D_2/T_2 reactions
《Chinese Physics B》2014年第12期138-142,共5页李永庆 赵金峰 张永嘉 迟晓琳 丁勇 马凤才 
Project supported by the National Natural Science Foundation of China(Grant Nos.11474141 and 11274149);the Program of Shenyang Key Laboratory of Optoelectronic Materials and Technology,China(Grant No.F12-254-1-00);the Scientific Research Foundation for Doctors of Liaoning University;the Special Fund Based Research New Technology of Methanol Conversion and Coal Instead of Oil;the China Postdoctoral Science Foundation(Grant No.2014M550158);the Program for Liaoning Excellent Talents in University(Grant No.LJQ2014001)
The effects of isotopic variants on stereodynamic properties for the title reactions have been investigated using a quasi-classical trajectory method based on the first excited state NH2（I^2A＇） potential energy sur...
关键词：quasi-classical trajectory method STEREODYNAMICS potential energy surface product polarization 
Theoretical study of stereodynamics for the D'+ DS(v=0,j=0) → D'D + S abstraction reaction
《Chinese Physics B》2013年第5期279-284,共6页郭雅慧 张凤昀 马红章 
Project supported by the National Natural Science Foundation of China (Grant Nos. 41201336 and 41001250);the Fundamental Research Funds for the Central Universities of China (Grant No. 13CX02018A)
Quasiclassical trajectory （QCT） calculations have been performed for the abstraction reaction, Dt＋ DS（v = 0, j = 0） → D＇D ＋ S on a new LZHH potential energy surface （PES） of the adiabatic 3A＇＇ electronic s...
关键词：quasi-classical trajectory integral cross section STEREODYNAMICS product polarization 
Theoretical study of stereodynamics for the reaction O(3P) ＋D2 (v=0, j=0) →OD＋D and isotope effect
《Chinese Physics B》2011年第6期189-196,共8页许增慧 宗福建 
Quasi-classical trajectory （QCT） calculations have been performed to study the product polarization behaviours in the reaction O（3p） ＋ D2 （v = 0, j = 0） → OD ＋ D. By running trajectories on the 3A′ and 3A″p...
关键词：chemical stereodynamics quasiclassical trajectory calculation isotope effect vector correlation 
Theoretical study of stereodynamics for the O（3P） ＋ H2 → OH ＋ H reaction
《Chinese Physics B》2011年第1期333-338,共6页刘世莉 石英 
Project supported by Jilin University,China(Grant No.419080106440)
This paper employs the quasi-classical trajectory calculations to study the influence of collision energy on the title reaction on the potential energy surface of the ground 3A1 triplet state developed by Rogers et a...
关键词：quasi-classical trajectory polarisation-dependent generalised differential cross-sections STEREODYNAMICS 
Theoretical study of stereodynamics for reaction O（3p）＋HCl
《Chinese Physics B》2010年第8期350-355,共6页朱通 扈国栋 陈建中 刘新国 张庆刚 
Project supported by the National Natural Science Foundation of China(Grant Nos.10474060 and 10504017);the Natural Science Foundation of Shandong Province,China(Grant No.2007A05)
The vector correlation between products and reagents for reaction O（3P）＋HCl→OH＋Cl is studied using a quasi- classical trajectory （QCT） method on the benchmark potential energy surface of the ground 3A″ state [...
关键词：product rotational polarization vector correlations differential cross sections quasi-classical trajectory 
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