[1] Yingxiang Cai*, Yuqing Guo, Bo Jiang, Yanan Lv. Encapsulation of cathode in lithium-sulfur batteries with a novel two-dimensional carbon allotrope: DHP-graphene. Sci. Rep.7:14948, (2017).
[2] Yingxiang Cai*, Jiamin Xiong, Yabo Liu, Xuechun Xu. Electronic structure and chemical hydrogen storage of a porous sp3 tetragonal BC2N compound. J. Alloys Compd.724: 229-233 (2017).
[3] Xuechun Xu, Bo Jiang, Yuqing Guo, Yingxiang Cai*, THD-graphene used for a selective gas detector. Mater. Chem. Phys.200:50-56 (2017).
[4] Yingxiang Cai*, Yuqing Guo, Xuechun Xu and Bo Jiang, First-principle investigation of dehalogenation 2,5-diiodo-3,4-ethylenedioxythiophene molecule adsorption on Cu(110)-(2 × 1)O surface. Surf. Sci., 665:83-88 (2017).
[5] Heng Liu, Yujie Hu, Hao Wang, Bo Jiang, Xuechun Xu and Yingxiang Cai*, Dissociation and reconstruction of double-decker bis(phthalocyaninato) terbium(III) complex (TbPc2) on Pd(001): A theoretical investigation. Surf. Sci., 655:12 (2017).
[6] Yingxiang Cai*, Hao Wang, Shengliang Xu, Yujie Hu, Ning Liu and Xuechun Xu, Multiporous carbon allotropes transformed from symmetry-matched carbon nanotubes. AIP Advances, 6:065225 (2016).
[7] Yu-Jie Hu, Sheng-Liang Xu, Hao Wang, Heng Liu, Xue-Chun Xu, Ying-Xiang Cai*, Superhard BC2N: an Orthogonal Crystal Obtained by Transversely Compressing (3,0)-CNTs and (3,0)-BNNTs. Chin. Phys. Lett., 33:106102 (2016).
[8] Yingxiang Cai*, Shengliang Xu, Xuelei Qiao, Lidong Wang, Yabo Liu, Tianyu Wang and Xuechun Xu, Chirality control of nonplanar lead phthalocyanine (PbPc) and its potential application in high-density storage: a theoretical investigation. Phys. Chem. Chem. Phys., 17:23651-23656 (2015).
[9] Shengliang Xu, Lidong Wang, Yabo Liu, Rui Yuan, Xuechun Xu, Yingxiang Cai*, Lightweight superhard carbon allotropes obtained by transversely compressing the smallest CNTs under high pressure, Phys. Lett. A, 379:2116 (2015).
[10] Shengliang Xu, Lidong Wang, Xuelei Qiao, Xuechun Xu and Yingxiang Cai*, Novel BN polymorphs transformed from the smallest BNNTs under high pressure. Comp. Mater. Sci., 110:241-246 (2015).
[11] Juan Liu, Chao Li, Xiaoqing Liu, Yan Lu, Feifei Xiang, Xuelei Qiao, Yingxiang Cai, Zhongping Wang, Sanqiu Liu, and Li Wang. Positioning and Switching Phthalocyanine Molecules on a Cu(100) Surface at Room Temperature. ACS Nano, 8:12734 (2014).
[12] Du Xinli, Chen Feng, Chen Xiu, Wu Xianxin, Cai Yingxiang, Liu Xiaoqing and Wang Li. Adsorption geometry of individual fullerene on Si surface at room-temperature. Appl. Phys. Lett., 97:253106 (2010)
[13] Chen Feng, Chen Xiu, Liu Lacheng, Song Xin, Liu Shuyi, Liu Juan, Ouyang Hongping, Cai Yingxiang, Liu Xiaoqing, Pan Haibing, Zhu Junfa and Wang Li, Chiral recognition of zinc phthalocyanine on Cu(100) surface, Appl. Phys. Lett., 100:081602 (2012)
[14] Lacheng Liu, Shuyi Liu, Xiu Chen, Chao Li, Jie Ling, Xiaoqing Liu, Yingxiang Cai and Li Wang, Switching Molecular Orientation of Individual Fullerene at Room Temperature. Sci. Rep., 3:3062 (2013).
[15] Wu Xianxin, Cai Yingxiang, Xie Qing, Weng Hongming, Fan Heng and Hu Jiangping. Magnetic ordering and multiferroicity in MnI2, Phys. Rev. B, 86:134413 (2012).
[16] Xiaoqing Liu, Yongli Wang, Xin Song, Feng Chen, Hongping Ouyang, Xueao Zhang, Yingxiang Cai, Xiaoming Liu and Li Wang. Role of Thermal Process on Self-Assembled Structures of 4'-([2,2':6',2''-Terpyridin]-4'-Yl)-[1,1'-Biphenyl]-4-Carboxylic Acid on Au(III) Int. J. Mol. Sci., 14:5686 (2013).
[17] Ruilin Xu, Juan Liu, Feng Chen, Nianhua Liu, Yingxiang Cai, Xiaoqing Liu, Xin Song, Mingdong Dong and Li Wang*. Room temperature tracking of chiral recognition process at the single molecule level. Nano Res., 8:3505-3511 (2015).
[18] Yingxiang Cai*, Xuelei Qiao, Adsorption and reconstruction of metal-phthalocyanine molecules on Pt(001) investigated by density functional theory, Surf. Sci., 630:202 (2014).
[19] Yingxiang Cai*, Xianxin Wu, Hengjin Liu, Wenchao Fu, Qian Liu, The adsorption and reconstruction of strong electron acceptor tetracyanoethylene (TCNE) on Si(001)-(2 × 1): A density functional theory investigation, Surf. Sci., 606: 523 (2012).
[20] Xuefu Zhang, Yingxiang Cai*, Feng Chen, Huihui Kong, Hongping OuYang, Shuyi Liu, Xiaoqing Liu and Li Wang*. Ag-induced Si(100) reconstruction: Si(100)-(2√2×2√2)R45º-Ag. Phys. Rev. B, 84:153411 (2011).
[21] Cai Ying-Xiang* and Xu Rui, First-Principles Study of the γ Angle Deformation Path in the Wurtzite-to-Rocksalt Phase Transition in Aluminum Nitride. Chinese Phys. Lett., 27:096402 (2010).
[22] Xinli Du, Feng Chen, Xiu Chen, Xianxin Wu, Yingxiang Cai, Xiaoqing Liu and Li Wang*, Adsorption geometry of individual fullerene on Si surface at room-temperature. Appl. Phys. Lett., 97:253106 (2010).
[23] Cai Ying-Xiang* and Xu Rui, Synthesizing Metastable Rocksalt-Type MgTe Based on High-Pressure Solid-State Phase Transition: A First-Principles Study. Chinese Phys. Lett., 26:113101 (2009).
[24] Liu Changle*, Yu Jie, Wu Songtao, Cai Yingxiang and Pan Wanjiang, Preliminary Design and Analysis of ITER In-Wall Shielding. Plasma Sci. Technol., 9:94 (2007).
[25] Yingxiang Cai* and Rui Xu, Atomic mechanism of zinc-blende to NiAs high-pressure phase transition in BeTe. J. Phys.: Condens. Matter, 20:485218 (2008).
[26] Cai Yingxiang*, Wu Songtao, Yu Jie and Liu Changle, Structural Analysis of ITER Lower In-Vessel-Viewing Port. Plasma Sci. Technol., 8:736 (2006).
[27] Cai Yingxiang*, Wu Songtao and Yu Jie, Structural Analysis of the ITER VV Lower Port Region. Plasma Sci. Technol., 9:492 (2007).
[28] Cai Yingxiang*, Yu Jie and Wu Songtao, The Effect of Hydrostatic Pressure and Seismic Load on ITER Lower Cryopump Ports. Plasma Sci. Technol., 9:216 (2007).
[29] Yingxiang Cai*, Songtao Wu, Rui Xu, and Jie Yu, Pressure-induced phase transition and its atomistic mechanism in BeO: A theoretical calculation. Phys. Rev. B, 73:184104 (2006).
[30] Yingxiang Cai*, Songtao Wu, Jie Yu, and Rui Xu, Structural stability and phase-transition mechanism of MgTe under pressure. Phys. Rev. B, 74: 214112 (2006).
注*为通讯作用
