Spectroscopic properties and design of highly luminescent lanthanide coordination complexes von de Sá, G.F, Malta, O.L, de Mello Donegá, C, Simas, A.M, Longo, R.L, Santa-Cruz, P.A, da Silva, E.F

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Synthesis and two-photon absorption spectrum of fluorenone-based molecules von Dipold, J., Batista, R.J.M.B., Fonseca, R.D., Silva, D.L., Moura, G.L.C., dos Anjos, J.V., Simas, A.M., De Boni, L., Mendonca, C.R.

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Nonlinear absorption of new mesoionic compounds von Pilla, V., de Araújo, Cid B., Lira, B.F., Simas, A.M., Miller, J., Athayde-Filho, P.F.

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Exact topological twistons in crystalline polyethylene von Ventura, E., Simas, A.M., Bazeia, D.

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Diffusion, reaction kinetics and exchange of sodium in aqueous solutions containing a crown ether von Hallwass, Fernando, Engelsberg, M., Simas, A.M., Barros, Wilson

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Two-photon absorption in mesoionic compounds pumped at the visible and at the infrared von Rakov, N, de Araújo, Cid B, da Rocha, G.B, Simas, A.M, Athayde-Filho, P.A.F, Miller, J

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Ultrafast dynamics of mesoionic liquid solutions studied with incoherent light von Menezes, L.de S., de Araújo, Cid B., Alencar, M.A.R.C., Athayde-Filho, P.F., Miller, J., Simas, A.M.

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Mesoionic rings as third-order non-linear optical materials von Bezerra, A.G, Gomes, A.S.L, Athayde-Filho, P.F, da Rocha, G.B, Miller, J, Simas, A.M

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Anion influence on complex formation between 18-crown-6 and sodium ion in aqueous solutions von Yuldasheva, L.N., Hallwass, F., da Cruz Gonçalves, S.M., Simas, A.M., Krasilnikov, O.V.

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Crystallographic and theoretical investigations of the preferred conformations of three isomeric N-acetyl-dihydro-oxadiazoles von Carpenter, G.B., Ventura, E., De Morais, L.P.F., Srivastava, R.M., Simas, A.M., Faure, R.

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On the implicit integral character of Roothaan's expansion von DACOSTA, H. F. M, TRSIC, M, DA SILVA, A. B. F, SIMAS, A. M

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Theoretical Prediction of the Structure and Electronic Spectra of Lanthanide Complexes von Simas, A.M., Rocha, G.B., Sá, G.F. de, de Mesquita, M.E.

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THE GENERATOR-COORDINATE HARTREE-FOCK METHOD FOR MOLECULAR-SYSTEMS - NEAR HARTREE-FOCK LIMIT CALCULATIONS FOR N2, CO AND BF von DACOSTA, HFM, SIMAS, AM, SMITH, VH, TRSIC, M

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The generator coordinate Hartree-Fock method for molecular systems. Formalism and first applications to H2, LiH and Li2 von da Costa, H.F.M., da Silva, A.B.F., Mohallem, J.R., Simas, A.M., Trsic, M.

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The generator coordinate Hartree—Fock method for molecular systems. Near Hartree—Fock limit calculations for N 2, CO and BF von da Costa, H.F.M., Simas, A.M., Smith, V.H., Trsic, M.

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Topographical features of the Laplacian of the momentum density of atoms and ions most indicative of shell structure von SAGAR, R. P, KU, A. C. T, SMITH, V. H, SIMAS, A. M

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Momentum-space properties of the neutral atoms from H through U von Westgate, William M., Sagar, Robin P., Farazdel, Abbas, Smith, Vedene H., Simas, Alfredo M., Thakkar, Ajit J.

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REACTIONS OF AROYL CHLORIDES WITH 1,4-DIPHENYLTHIOSEMICARBAZIDE: FORMATION OF BOTH 1,3,4-THIADIAZOLIUM-2-AMINIDES AND 1,3,4-TRIAZOLIUM-2-THIOLATE von Echevarria, A., Galembeck, S.E., Maciel, M.A.M., Miller, J., Montanari, C.A., Rumjanek, V.M., Simas, A.M., Sandall, J.B.P.

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The generator coordinate Hartree-Fock method for molecular systems. Formalism and first applications to H 2, LiH and Li 2 von da Costa, H.F.M., da Silva, A.B.F., Mohallem, J.R., Simas, A.M., Trsic, M.

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molecular orbital calculations of the polar tensors and vibrational intensities of HC3N von Ramos, M.N., Neto, B.B., Simas, A.M., Bruns, R.E.

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