Journal of Atomic and Molecular Physics 2016 Issue 5 Ab initio study of the potential energy surface and microwave spectra for the Ar-CS2 complex

Ab initio study of the potential energy surface and microwave spectra for the Ar-CS2 complex
CHEN Jian;,REN Gang;,Feng Er-Ying;,HUANG Wu-Ying;

..............page:753-759

Density functional theory study of two state reactivity of NO activation on Fe4 cluster
LIAO Wen-Yu;,SU Ya-Xin;,ZHOU Hao;,QI Yue-Zhou;

..............page:760-766

Synthesis of an epoxy resin curing agent containing maleic imide and study of its structure, spectra and thermodynamic properties
CHEN Zi-Ran;,XU You-Hui;,HE Zhan-Rong;,TAO Guo;,XIAO Man;

..............page:767-772

A theoretical prediction of the relationships between the impact sensitivity and electrostatic potential in nitrocyclobutane explosive with the C-NO2 groups and its derivatives
GUO Xiao-Juan;,LI Bin;,REN Fu-De;,ZHAO Guang-Ming;

..............page:773-778

First-principles study on the hydrogenation of the O2 on CrN4 embedded graphene
XU Qing-Ran;,LI Shuo;,LI Yan;,XUE Jie;,ZHANG Xi-Lin;,LU Zhan-Sheng;,YANG Zong-Xian;

..............page:779-784

The spectroscopic constants and molecular constants of low-lying excited states of MgH molecule
WU Dong-Lan;,TAN Bin;,WEN Yu-Feng;,WAN Hui-jun;,XIE An-Dong;

..............page:785-790

Density functional study on the structures of iron berberine compound
LU Jun;,LU Qing-Hua;,YANG Ju-Cai;

..............page:791-800

Theoretical study on the reaction between NH3 and MgH2
DONG Xiao;

..............page:801-806

Study of the ground-state structural properties of Morse clusters Mn (n=2-100) by the simulated quenching algorithm
FANG Meng;,HAMID Ilyar;,DUAN Hai-Ming;

..............page:807-812

Structural, electronic and magnetic properties of (CoO) n(n≤6) clusters
LV Jin;,ZHANG Jiang-Yan;,QIN Jian-Ping;

..............page:813-821

The density functional theory study of Nin(0,±)(n=1-9) clusters
WEN Jun-Qing;,XU Wei-Feng;,LIU Ke-Yang;,CHEN Guo-Xiang;,WEN Zhen-Yi;

..............page:822-828

Theoretical investigation of the structures and vibrational frequencies of adenine-water clusters
CHEN Wen-Long;,KONG Ge;,ZHOU Liu-Zhu;,KONG Xiang-He;

..............page:829-835

The reaction cross sections of H(1s) + H(1s) collisions investigated by atomic orbital close-coupling method
CHEN Lan-Fang;

..............page:836-840

Theoretical study on the ionization process from neutral atomic K shell electron collided by fully stripped ion
WANG Xia;,MA Kun;,JIANG Jun;,DONG Chen-Zhong;

..............page:841-848

Experimental research of the threshold conditions of runaway electron in tokamk
YANG De-Wu;,ZHU Jin-Xia;,YAO Lie-Ming;

..............page:849-854

Ultrabroad bandwidth generation by using three-color mid-infrared spatial inhomogeneous field
FENG Li-Qiang;

..............page:855-862

Collapse in extra-intense laser plasma under Compton scattering
ZHANG Kai-Ping;,MAO Jian-Jing;,HAO Dong-Shan;

..............page:863-867

Entanglement in a three-qubit ferrmagnetic heisenberg spin chain system
XI Yu-Xing;,ZHAO Yuan-Li;,HUANG Yan-Xia;

..............page:868-872

Quantum entanglement and coherence in two coupled nonlinear oscillators
TANG Zhu-Rong;,RUAN Xiao-Shuang;,CHEN Geng-Xiang;,HOU Xi-Wen;

..............page:873-876

Ultrashort attosecond X-ray source generation by using the spatial inhomogeneous polarization gating scheme
LIU Hang;,FENG Li-Qiang;

..............page:877-885

Control of the size and magnetic property for Fe3 O4@SiO2@TiO2 composite microstructures
LI Man-Hong;,WANG Fang;

..............page:886-892

First-principles analyses of the adsorption properties of CO2 molecule on CaO (100) surfaces
LI Xiao-Dong;,LIU Cheng-Long;,WANG Chang-Qin;,MA Hai-Xia;

..............page:893-900

Theoretical study of structures and elastic mechanics of VTiTaNbAl x high-entropy alloys
XIONG Qing-Yun;,SHEN Jiang;,TIAN Fu-Yang;

..............page:901-906

The structures and hydrogen storage properties of lithium decorated on the end of the boron atomic chain clusters
RUAN Wen;,WU Dong-Lan;,LUO Wen-Lang;,YU Xiao-Guang;,XIE An-Dong;,SONG Hong-Lian;,CAI Yu-Feng;,ZENG Hua-Dong;,JIN Shi-Xian;

..............page:907-912

Study of the coalescence and release of helium bubble under metal surface
ZHANG Bao-Ling;

..............page:913-918

First-principles study of water desorption on hydrated montmorillonite surface
ZHANG Yao;,MENG Ying-Feng;

..............page:919-922

Theoretical study on the interaction between an oxygen atom and C60-Ih cage
JIA Guo-Rong;,HAO Ce;,JIN Ying-Fu;,MI Wei-Hong;

..............page:923-928

Effect of defects on the electronic structure of monolayer MoS2
CHEN Xiao-Hong;,FU Chun-Ping;

..............page:929-933

Field-driven evolution of spin texture in a low dimensional helimagnet nanostrip
TANG Dan;,QI Yang;

..............page:934-940

The electronic structures and magnetism of half-metallic CrO2 bulk and (0 0 1) (1 0 0) surfaces
ZHANG Yuan-Qiang;,YANG Xiu-De;

..............page:941-945

First-principles study of helium defect effects on the structure and elastic modulus of α-Fe
TANG Xin-Zheng;,PENG Lei;,SHI Jing-Yi;,BAI Yong-An;

..............page:946-950

Insight into interaction mechanism of inhibitor benzamidine with trypsin by using calculation of binding free energy
WANG Qing;,LIANG Zhi-Qiang;,WANG Wei;,YI Chang-Hong;,LI Hong-Yun;,ZHAO Juan;

..............page:951-956