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Polarizability evolution on natural and artificial low dimensional binary semiconductor systems: A case study of stoichiometric aluminum phosphide semiconductor clusters.
J Chem Phys. 2008 Sep 7;129(9):094708. doi: 10.1063/1.2976771.
J Chem Phys. 2008.
PMID: 19044887
Structure and ultrafast dynamics of liquid water: a quantum mechanics/molecular mechanics molecular dynamics simulations study.
Xenides D, Randolf BR, Rode BM.
Xenides D, et al.
J Chem Phys. 2005 May 1;122(17):174506. doi: 10.1063/1.1888465.
J Chem Phys. 2005.
PMID: 15910044
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Trends of the bonding effect on the performance of DFT methods in electric properties calculations: a pattern recognition and metric space approach on some XY2 (X = O, S and Y = H, O, F, S, Cl) molecules.
Christodouleas C, Xenides D, Simos TE.
Christodouleas C, et al. Among authors: xenides d.
J Comput Chem. 2010 Jan 30;31(2):412-20. doi: 10.1002/jcc.21328.
J Comput Chem. 2010.
PMID: 19499538
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