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RESEARCH PAPER · Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy · 2013

Computational study on the molecular structures and photoelectron spectra of bimetallic oxide clusters (M=V, Nb, Ta)

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Computational study on the molecular structures and photoelectron spectra of bimetallic oxide clusters (M=V, Nb, Ta)OriginalTheoretical studies on the electronic structures and photoelectron spectra of tri-rhenium oxide clusters: Re3 O n - and Re3O (n= 1–6)4Enhancing the adsorption capacity of Sr 2+ and Cs + onto hexagonal tungsten oxide by doped niobium20Properties of two-dimensional insulators: A DFT study of bimetallic oxide CrW2O9 clusters adsorption on MgO ultrathin films6Tuning the charge states of CrW2O9 clusters deposited on perfect and defective MgO(001) surfaces with different color centers: A comprehensive DFT study5Theoretical investigations on the d-p hybridized aromaticity, photoelectron spectroscopy and neutral salts of the LaX2− (X=Al, Ga, In) clusters16Octahedral {Ta6I12} Clusters23Revealing the effect of the oriented external electronic field on the superatom-polymeric Zr3O3 cluster: Superhalogen modulation and spectroscopic characteristics14Niobium and tantalum octahedral Halides: Vibrational properties and Intra–Cluster interactions5

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  1. Theoretical studies on the electronic structures and photoelectron spectra of tri-rhenium oxide clusters: Re3 O n - and Re3O (n= 1–6)

    Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy · 2013-09-25

    Qi Zhou, Wei-Chao Gong, Lu Xie, Cun-Gong Zheng, Wei Yan Zhang, Bin Wang, Yongfan Zhang, Xin Huang

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  2. Enhancing the adsorption capacity of Sr 2+ and Cs + onto hexagonal tungsten oxide by doped niobium

    RSC Advances · 2015-01-01

    Bijun Liu, Wanjun Mu, Xiang Xie, Xingliang Li, Hongyuan Wei, Zhaoyi Tan, Yuan Jian, Shunzhong Luo

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  3. Properties of two-dimensional insulators: A DFT study of bimetallic oxide CrW2O9 clusters adsorption on MgO ultrathin films

    Applied Surface Science · 2016-04-06

    Jia Zhu, Hui Zhang, Ling Zhao, Wei Xiong, Xin Huang, Bin Wang, Yongfan Zhang

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  4. Tuning the charge states of CrW2O9 clusters deposited on perfect and defective MgO(001) surfaces with different color centers: A comprehensive DFT study

    The Journal of Chemical Physics · 2016-05-03

    Jia Zhu, Hui Zhang, Yawen Tong, Chengxing Wang, Bin Wang, Xin Huang, Yongfan Zhang

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  5. Theoretical investigations on the d-p hybridized aromaticity, photoelectron spectroscopy and neutral salts of the LaX2− (X=Al, Ga, In) clusters

    Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy · 2018-05-29

    Jing Chen, Huan Yang, Jing Wang, Shi‐Bo Cheng

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  6. Octahedral {Ta6I12} Clusters

    Inorganic Chemistry · 2019-06-24

    Maxim Shamshurin, Maxim A. Mikhaylov, Taisiya Sergeevna Sukhikh, Enrico Benassi, Alexandra R. Tarkova, A. A. Prokhorikhin, Evgeniy I. Kretov, Michael A. Shestopalov, Pavel A. Abramov⧫, Maxim N. Sokolov⧫

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  7. Revealing the effect of the oriented external electronic field on the superatom-polymeric Zr3O3 cluster: Superhalogen modulation and spectroscopic characteristics

    Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy · 2020-04-22

    Jing Chen, Huan Yang, Jing Wang, Shi‐Bo Cheng

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  8. Niobium and tantalum octahedral Halides: Vibrational properties and Intra–Cluster interactions

    Polyhedron · 2022-08-27

    Maxim Shamshurin, Svetlana A. Martynova, Maxim N. Sokolov⧫, Enrico Benassi

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