1. Xiang H. P., Zhang X., Neuhauser D., Lu G., Size-dependent plasmonic resonances from large-scale quantum simulations.Journal of Physical Chemistry Letters5, 1163 (2014).
2. Xiang H. P., Zhang M. L. Zhang X. Lu G. Understanding Quantum Plasmonics from Time-Dependent Orbital-Free Density Functional Theory.Journal of Physical Chemistry C120, 14330(2016).
3. Zhang M. L.Xiang. H. P., Zhang X. Lu G. Quantum electrodynamics and plasmonic resonance of metallic nanostructures.Journal of Physics: Condensed Matter28,155302 (2016).
4. Chaudhuri, D.,Xiang H. P., Lefkidis, G., Huebner, W., Laser-induced ultrafast spin dynamics in di-, tri- and tetranuclear nickel clusters, and the M process.Physical Review B90, 245113(2014).
5. Xiang H. P.*, Lefkidis G., Hübner W., First-principles study of the ultrafast, laser-induced spin transferability in the multi-center magnetic cluster Ni3Na2.Journal of Superconductivity and Novel Magnetism26, 2001 (2013).
6. Xiang H. P.*, Lefkidis G., Hübner W. Unified theory of ultrafast femtosecond and conventional picosecond magnetic dynamics in the distorted metallic three-center magnetic cluster Ni3Na2.Physical Review B86, 134402 (2012).
7. Tang X. J.,Xiang H. P., Liu X. H., Dronskowski R. A ferromagnetic carbodiimide: Cr2(NCN)3.Angewandte Chemie122, 4846 (2010).
8. Xiang H. P., Dronskowski R., Eck B., Tchougreeff A L. Influence of Coulomb correlation and spin-orbital coupling on the electronic and magnetic structures of MNCN (M = Fe, Co, Ni).Journal of Physical Chemistry A114, 12345 (2010).
9. Xiang H. P., Liu X. H., Dronskowski R. A theoretical re-investigation of the electronic structure of CuNCN: the influence of packing on the magnetic properties.Journal of Physical Chemistry C113, 18891(2009).
10. Zhang S. Y.,Xiang H. P.*, Guo W. B., Tang Y. Y., Cui M. Y., He Z. Z. Synthesis, characterization, and mechanism analysis ofS= 2 quasi-one-dimensional ferromagnetic semiconductor Pb2Mn(VO4)2(OH).Dalton Transactions45, 7022 (2016).
11. Xiang H. P.*,Tang Y. Y., Zhang S. Y., He Z. Z.Intra-chain superexchange couplings in quasi-1D 3dtransition-metal magnetic compounds.Journal of Physics: Condensed Matter28,276003 (2016).
12. Xiang H. P., Wu Z. J., Ab initio study on the electronic, magnetic and mechanical properties of CaCu3V4O12.Inorganic Chemistry47, 2706 (2008).
13. Xiang H. P., Liu X. J., Zhao E. J., Meng J., Wu Z. J., Magnetic and electronic properties of CaCu3Cr4O12and CaCu3Cr2Sb2O12by first-principles density functional calculation. Inorganic Chemistry46, 9575 (2007).
14. Xiang H. P., Liu X. J., Zhao E. J., Meng J., Wu Z. J., Ferrimagnetic and half-metallic CaCu3Fe4O12: Prediction from first principles investigation.Applied Physics Letters91, 011903(2007).
15. Xiang H. P., Liu X. J., Zhao E. J., Meng J., Wu Z. J., First-principles study on the conducting mechanism of the heavy-fermion system CaCu3Ru4O12.Physical Review B76, 155103 (2007).
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