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Submissions from 2016

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Manipulating Magnetism at Organic/Ferromagnetic Interfaces by Molecule-Induced Surface Reconstruction, Rui Pang, Xingqiang Shi, and Michel A. Van Hove

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Manipulating magnetism at organic/ferromagnetic interfaces by molecule-induced surface reconstruction, Rui Pang, Xingqiang Shi, and Michel Andre Van Hove

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Computational prediction of optimal metal ions to induce coordinated polymerization of muscle-like [c2]daisy chains, Yan-Ling Zhao, Rui-Qin Zhang, Christian Minot, Klaus Hermann, and Michel Andre Van Hove

Submissions from 2015

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High-resolution model for noncontact atomic force microscopy with a flexible molecule on the tip apex, Chun-Sheng Guo, Michel Andre Van Hove, Xinguo Ren, and Yong Zhao

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Origin of the contrast interpreted as intermolecular and intramolecular bonds in atomic force microscopy images, Chun-Sheng Guo, Xiaojun Xin, Michel Andre Van Hove, Xinguo Ren, and Yong Zhao

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Self-doping and magnetic ordering induced by extended line defects in graphene, Ji-Chang Ren, Zejun Ding, Rui-Qin Zhang, and Michel Andre Van Hove

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Enhancement of spin polarization induced by Coulomb on-site repulsion between localized pz electrons in graphene embedded with line defects, Ji-Chang Ren, Zhigang Wang, Rui-Qin Zhang, Zejun Ding, and Michel Andre Van Hove

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Computational prediction of optimal metal ions to induce coordinated polymerization of muscle-like [c2]daisy chains, Yan-Ling Zhao, Rui-Qin Zhang, Christian Minot, Klaus Hermann, and Michel A. Van Hove

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Revealing highly unbalanced energy barriers in the extension and contraction of the muscle-like motion of a [c2]daisy chain, Yan-Ling Zhao, Rui-Qin Zhang, Christian Minot, Klaus Hermann, and Michel Andre Van Hove

Submissions from 2014

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Oxygen vacancy diffusion in bare ZnO nanowires, Bei Deng, Andreia Luisa Da Rosa, Th. Frauenheim, J. P. Xiao, X. Q. Shi, R. Q. Zhang, and Michel Andre Van Hove

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Stabilizing reconstruction induced by O protrusions of the ZnO (0001) polar surface, Yu Li, Bolong Huang, Rui-Qin Zhang, Zijing Lin, and Michel Andre Van Hove

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Strong slip-induced anomalous enhancement and red-shifts in wide-range optical absorption of graphite under uniaxial pressure, Ji-Chang Ren, Rui-Qin Zhang, Zejun Ding, and Michel Andre Van Hove

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Symmetry-dependent band gap opening in graphene induced by g-C3N4 substrates, Ji-Chang Ren, Rui-Qin Zhang, Zejun Ding, and Michel Andre Van Hove

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Stabilizing forces acting on ZnO polar surfaces: STM, LEED, and DFT, H. Xu, L. Dong, X. Q. Shi, Michel Andre Van Hove, W. K. Ho, N. Lin, H. S. Wu, and S. Y. Tong

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Selective adsorption of L-serine functional groups on the anatase TiO2(101) surface in benthic microbial fuel cells, Yan-Ling Zhao, Cui-Hong Wang, Ying Zhai, Rui-Qin Zhang, and Michel Andre Van Hove

Submissions from 2013

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Cooperative modulation of electronic structures of aromatic molecules coupled to multiple metal contacts, Weihua Wang, Xingqiang Shi, Shiyong Wang, Jun Liu, Andre Michel Van Hove, Pei Nian Liu, Rui-Qin Zhang, and Nian Lin

Submissions from 2012

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Inducing extended line defects in graphene by linear adsorption of C and N atoms, Yu Li, Rui-Qin Zhang, Zijing Lin, and Michel Andre Van Hove

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A random rotor molecule: Vibrational analysis and molecular dynamics simulations, Yu Li, Rui-Qin Zhang, Xing-Qiang Shi, Zijing Lin, and Michel Andre Van Hove

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Interactions between organics and metal surfaces in the intermediate regime between physisorption and chemisorption, Xing-Qiang Shi, Yu Li, Michel Andre Van Hove, and Rui-Qin Zhang