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Russian Journal of General Chemistry, Vol. 79, Iss. 11, 2009-11 ,pp. : 2354-2358

MAIK Nauka/Interperiodica

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Ab initio and density functional studies of cooperative hydrogen bonding in calix[4]-and calix[6]arenes

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IR Spectra of Ethane Adsorbed on the Hydrogen, Sodium, and Zinc Forms of a Y-Type Zeolite: Interpretation Using ab initio Quantum Chemical Calculations

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Analysis of the Tautomeric Properties of 2-Formylcyclopentane-1,3-Dione Using the Data of IR Spectroscopy and Nonempirical (ab initio and DFT) Quantum-Chemical Calculations

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Comparison of Theoretical Methods and Basis Sets for ab initio and DFT Calculations of the Structure and Frequencies of Normal Vibrations of Polyatomic Molecules

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