Synthesis, thermal and structural properties of pure TeO2 glass and zinc-tellurite glasses von Tagiara, N.S., Palles, D., Simandiras, E.D., Psycharis, V., Kyritsis, A., Kamitsos, E.I.

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Short-Range Disorder in TeO2 Melt and Glass von Alderman, O. L. G, Benmore, C. J, Feller, S, Kamitsos, E. I, Simandiras, E. D, Liakos, D. G, Jesuit, M, Boyd, M, Packard, M, Weber, R

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Theoretical Study of Glass Systems using Molecular Electronic Structure Theory. 2. Structure and Spectroscopy of the B2O3 Glass von Liakos, D. G, Simandiras, E. D

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Asymmetric phthalocyanines (A3B type) containing aminophenoxy and hydroxyphenyl-diazenyl-phenoxy substituents von Thimiopoulos, A., Simandiras, E.D., Psaroudakis, N.

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Synthesis, characterization and DFT analysis of new phthalocyanine complexes containing sulfur rich substituents von Thimiopoulos, A., Vogiatzi, A., Simandiras, E.D., Mousdis, G.A., Psaroudakis, N.

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The elimination of singularities in derivative calculations von Handy, N.C., Amos, R.D., Gaw, J.F., Rice, J.E., Simandiras, E.D.

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Correction to "Short-Range Disorder in TeO 2 Melt and Glass" von Alderman, O L G, Benmore, C J, Feller, S, Kamitsos, E I, Simandiras, E D, Liakos, D G, Jesuit, M, Boyd, M, Packard, M, Weber, R

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Short-Range Disorder in TeO 2 Melt and Glass von Alderman, O L G, Benmore, C J, Feller, S, Kamitsos, E I, Simandiras, E D, Liakos, D G, Jesuit, M, Boyd, M, Packard, M, Weber, R

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Prediction and characterization of magnesium fluoride dimers and their non-classical hydrogen complexes von Simandiras, E.D., Nicolaides, C.A.

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The analytic evaluation of second-order møller-plesset (MP2) dipole moment derivatives von Simandiras, E.D., Amos, R.D., Handy, N.C.

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Short-Range Disorder in TeO2 Melt and Glass von Alderman, O. L. G., Benmore, C. J., Feller, S., Kamitsos, E. I., Simandiras, E. D., Liakos, D. G., Jesuit, M., Boyd, M., Packard, M., Weber, R.

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Hydrogen-bonded complexes involving HF and HCl: the effects of electron correlation and anharmonicity von Amos, R. D., Gaw, J. F., Handy, N. C., Simandiras, E. D., Somasundram, K.

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On the high accuracy of MP2-optimised geometries and harmonic frequencies with large basis sets von SIMANDIRAS, E. D, HANDY, N. C, AMOS, R. D

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Prediction of non-transition-metal hydrogen complexes von Nicolaides, Cleanthes A., Simandiras, Emmanuel D.

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Nonclassical hydrogen complexes of the alkaline earths von Simandiras, Emmanuel D., Nicolaides, Cleanthes A.

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The structure and harmonic vibrational frequencies of the weakly bound complexes formed by HF with CO, CO2 and N2O von Alberts, Ian L., Handy, Nicholas C., Simandiras, Emmanuel D.

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Second-order perturbation theory and configuration interaction theory applied to medium-sized molecules: cyclopropane, ethylenimine, ethylene oxide, fluoroethane, and acetaldehyde von Simandiras, Emmanuel D, Amos, Roger D, Handy, Nicholas C, Lee, Timothy J, Rice, Julia E, Remington, Richard B, Schaefer, Henry F

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A theoretical study on the solvolytic reactivity of the [Re 3(μ-Cl 3)Cl 9] n− clusters ( n=3,4) using ab initio and density functional theory calculations von Psaroudakis, Nikolaos, Mertis, Konstantinos, Liakos, Dimitrios G., Simandiras, Emmanuel D.

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The structure and vibrational frequencies of the ArH3+ ion and its isotopomers von SIMANDIRAS, E. D, GAW, J. F, HANDY, N. C

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