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ΤύποςΗμερομηνίαΤίτλοςΔημιουργόςΠλήρες κείμενο
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1997Low-temperature asymptotics of isotropic ferromagnetic chains at nonzero fieldsΘεοδωρακόπουλος, Νίκος; Μπακάλης, Ναούμ Χ.
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2000Interpretation of the spin glass behaviour of diluted magnetic semiconductors below the nearest-neighbour percolation threshold via realistic Monte Carlo simulationsKaraoulanis, D.; Xanthakis, J. P.; Μπακάλης, Ναούμ Χ.
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2000Existence of He-2(-) negative ions with two remote electrons in antibonding orbitalsΜπακάλης, Ναούμ Χ.
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2000Comment on the formation of He2-4Ig statesΜπακάλης, Ναούμ Χ.
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2001Applications of the NRL tight-binding method to magnetic systemsMehl, M. J.; Papaconstantopoulos, D. A.; Mazin, II; Μπακάλης, Ναούμ Χ.; Pickett, W. E.
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2001Transferable tight-binding parameters for ferromagnetic and paramagnetic ironΜπακάλης, Ναούμ Χ.; Papaconstantopoulos, D. A.; Mehl, M. J.; Lach-Hab, M.
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2003Accurate and concise atomic CI via generalization of analytic Laguerre type orbitals and examples of ab-initio error estimation for excited statesXiong, Z.; Μπακάλης, Ναούμ Χ.
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2004Description of the chemical reaction path in the HCO molecule: a combined configuration interaction and tight-binding approachΜπακάλης, Ναούμ Χ.; Μητρόπουλος, Αριστοφάνης; Papaconstantopoulos, D.A.
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2005Analytic atomic wave functions of NMCSCF quality: ApplicationsXiong, Z.; Velgakis, M. I.; Μπακάλης, Ναούμ Χ.
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2005Description of the lowest-energy surface of the CH+O system: Interpolation of ab initio configuration-interaction total energies by a tight-binding HamiltonianΜπακάλης, Ναούμ Χ.; Μητρόπουλος, Αριστοφάνης; Papaconstantopoulos, D. A.
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2005Generalization of Laguerre orbitals toward an accurate, concise and practical analytic atomic wave functionXiong, Z.; Μπακάλης, Ναούμ Χ.
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2006Analytic variationally optimized internally orthogonalized modified Laguerre orbitals in accurate atomic configuration interaction calculationXiong, Z.; Μπακάλης, Ναούμ Χ.
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2007Radiative decay from doubly to singly excited states of He via generalization of Laguerre-type orbitals: A non-orthogonal formalismXiong, Z.; Μπακάλης, Ναούμ Χ.
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2007Improving Φ0 via ψ1 (independently known): Exactly orthogonal wave functionsΜπακάλης, Ναούμ Χ.
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2008Variational functionals for excited statesΜπακάλης, Ναούμ Χ.
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2008Interaction of dioxygen with Al clusters and Al(111): A comparative theoretical studyMosch, C.; Koukounas, C.; Μπακάλης, Ναούμ Χ.; Μητρόπουλος, Αριστοφάνης; Gross, A.; Mavridis, A.
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2009Theoretical Investigation of the Interaction of CH(4) with Al(n) Neutral and Charged ClustersAlexandrou, E. I.; Μπακάλης, Ναούμ Χ.
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2009Remarks on the Hylleraas-Undheim and MacDonald Higher Roots, And Functionals Having Local Minimum at The Excited StatesΜπακάλης, Ναούμ Χ.; Xiong, Z.; Karaoulanis, D.
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2009A generic procedure for determining atomic LS spectral terms and their LS eigenfunctionsZhuang, Xiong; Μπακάλης, Ναούμ Χ.
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2009Properties of hydrogen terminated silicon nanocrystals via a transferable tight-binding Hamiltonian, based on ab-initio resultsΜπακάλης, Ναούμ Χ.; Zdetsis, A. D.
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