Ab initio quantum mechanical charge field (QMCF) molecular dynamics: a QM/MM–MD procedure for accurate simulations of ions and complexes BM Rode, TS Hofer, BR Randolf, CF Schwenk, D Xenides, ...
Theoretical Chemistry Accounts 115, 77-85, 2006
205 2006 Structure and ultrafast dynamics of liquid water: A quantum mechanics/molecular mechanics molecular dynamics simulations study D Xenides, BR Randolf, BM Rode
The Journal of chemical physics 122 (17), 2005
121 2005 Dipole, dipole–quadrupole, and dipole–octopole polarizability of adamantane, G Maroulis, D Xenides, U Hohm, A Loose
The Journal of Chemical Physics 115 (17), 7957-7967, 2001
110 2001 Hydrogen bonding in liquid water: An ab initio QM/MM MD simulation study D Xenides, BR Randolf, BM Rode
Journal of molecular liquids 123 (2-3), 61-67, 2006
82 2006 Basis set and electron correlation effects on the first and second static hyperpolarizability of SO2 D Xenides, G Maroulis
Chemical Physics Letters 319 (5-6), 618-624, 2000
68 2000 Enhanced Linear and Nonlinear Polarizabilities for the Li4 Cluster. How Satisfactory Is the Agreement between Theory and Experiment for the Static Dipole … G Maroulis, D Xenides
The Journal of Physical Chemistry A 103 (24), 4590-4593, 1999
65 1999 New basis sets for xenon and the interaction polarizability of two xenon atoms G Maroulis, A Haskopoulos, D Xenides
Chemical physics letters 396 (1-3), 59-65, 2004
58 2004 Interaction dipole moment, polarizability and hyperpolarizability in the KrXe heterodiatom A Haskopoulos, D Xenides, G Maroulis
Chemical physics 309 (2-3), 271-275, 2005
48 2005 Electric dipole and quadrupole moment and dipole polarizability of CS, SiO and SiS G Maroulis, C Makris, D Xenides, P Karamanis
Molecular Physics 98 (8), 481-491, 2000
40 2000 Electric Quadrupole and Hexadecapole Moment, Dipole and Quadrupole Polarizability, Second Electric Dipole Hyperpolarizability for P2 , and a Comparative Study of Molecular Polarization in N … G Maroulis, D Xenides
The Journal of Physical Chemistry A 107 (5), 712-719, 2003
34 2003 Combined experimental and theoretical treatment of the dipole polarizability of P 4 clusters U Hohm, A Loose, G Maroulis, D Xenides
Physical Review A 61 (5), 053202, 2000
29 2000 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 … C Christodouleas, D Xenides, TE Simos
Journal of Computational Chemistry 31 (2), 412-420, 2010
26 2010 Comparison of high-level post-Hartree–Fock and DFT methods on the calculation of interaction-induced electric properties of Kr–He D Xenides, A Hantzis, G Maroulis
Chemical Physics 382 (1-3), 80-87, 2011
25 2011 Polarizability evolution on natural and artificial low dimensional binary semiconductor systems: A case study of stoichiometric aluminum phosphide semiconductor clusters P Karamanis, D Xenides, J Leszczynski
The Journal of chemical physics 129 (9), 2008
25 2008 A critical analysis of the performance of new generation functionals on the calculation of the (hyper) polarizabilities of clusters of varying stoichiometry: Test case the … D Xenides, P Karamanis, C Pouchan
Chemical Physics Letters 498 (1-3), 134-139, 2010
24 2010 The polarizabilities of small stoichiometric aluminum phosphide clusters AlnPn (n= 2–9). Ab initio and density functional investigation P Karamanis, D Xenides, J Leszcszynski
Chemical Physics Letters 457 (1-3), 137-142, 2008
24 2008 On the performance of DFT methods on electric polarizability and hyperpolarizability calculations for the lithium tetramer G Maroulis, D Xenides
Computing Letters 1 (4), 246-252, 2005
23 2005 On the performance of DFT methods in (hyper) polarizability calculations: N4 (Td) as a test case D Xenides
Journal of Molecular Structure: THEOCHEM 804 (1-3), 41-46, 2007
21 2007 How does the closing of the ring affect the electric properties of sulphur dioxide? A comparison with the open and closed form of ozone D Xenides, G Maroulis
The Journal of Chemical Physics 115 (17), 7953-7956, 2001
15 2001 Synchronization in complex systems following a decision based queuing process: rhythmicapplause as a test case D Xenides, DS Vlachos, TE Simos
Journal of Statistical Mechanics: Theory and Experiment 2008 (07), P07017, 2008
14 2008 
George MaroulisDepartment of Chemistry, University of Patras, GR-26500 Patras, GreeceEmail yang diverifikasi di upatras.gr