J312. A. Kayembe, E. Lewars and J.F. Liebman, “The Quinones of Bicyclo[3.1.0]hexatriene: A Computational Study of Their Chemistry and Thermochemistry,” J. Chem. Thermodyn., 52, 43 – 56 (2012) (this invited, primary, refereed research article appears in the special issue entitled “Biothermodynamics” edited by Robert N. Goldberg)

J311. R. Notario, M. Temprado, M.V. Roux and J.F. Liebman, “Substituent Effects on the Thermochemistry of Thiophenes, A Theoretical (G3(MP2)//B3LYP and G3) Study,” J. Phys. Chem. A., 116, 4363 – 4370 (2012).

J310. M.S. Miranda, M.A.R. Matos, V.M.F. Morais and J.F. Liebman, “2,1,3-benzothiadiazole: Study of Its Structure, Energetics and Aromaticity,” J. Chem. Thermodyn., 50, 30-36 (2012).

J309. J. Morgan, A. Greenberg and J.F. Liebman, “Paradigms and Paradoxes: O- and N-Protonated Amides, Stabilization Energy and Resonance Energy,” Struct. Chem., 23, 197-199 (2012).

J308. M.V. Roux, M. Temprado, P. Jiménez, R. Notario, A.R. Parameswar, A.V. Demchenko, J.S. Chickos, C.A. Deakyne and J.F. Liebman, “Knowledge of a Molecule: An Experimental and Theoretical Study of the Structure and Enthalpy of Formation of Tetrahydro-2H-1,3-oxazine-2- thione,” J. Chem. Eng. Data, 56, 4725 – 4532 (2011). (This primary, invited, refereed research paper is in honor of Kenneth D. Marsh).

J307. M.S. Miranda, M.A.R. Matos, V.M.F. Morais and J.F. Liebman, “Energetics of Quinazoline- 2,4(1H,3H)-dione: An Experimental and Computational Study,” J. Chem. Eng. Data., 56, 4516- 4523 (2011). (This primary, invited, research paper is in honor of Kenneth D. Marsh).

J306. M.S. Miranda, M.A.R. Matos, V.M.F. Morais and J.F. Liebman, “Paradigms and Paradoxes: The Aromaticity of 6:6 Fused Carbocycles and Heterocycles as an Extension of a Study of Indane and Indene Derivatives,” Struct. Chem., 22, 1221 ─ 1224 (2011).

J305. K.F. Edwards and J.F. Liebman, “Amphoteric, Amphihydric and Ambisaline: Are These Descriptive Concepts Manifestations of Convenience, Anthropocentrism, or Folksonomy?” Int. J. Chem. Model., 3, 213 – 226 (2011). (This invited, refereed, primary research paper is in honor of 65th Eduardo A. Castro on the occasion of his birthday). (This paper was reproduced in slightly modified form as K.F. Edwards and J.F. Liebman, “Amphoteric, Amphihydric and Ambisaline: Are These Descriptive Concepts Manifestations of Convenience, Anthropocentrism, or Folksonomy?” in Advances in Molecular Modeling, Vol. 3, 67-77 (2012) (ed. M. V. Putz, Nova Science Publishers, New York, 2012).

J304. M.S. Miranda, M.A.R. Matos, V.M.F. Morais and J.F. Liebman, “Study of Energetics and Structure of 1,2,3-Benzotriazin-4(3H)-one and its 1H and Enol Tautomers,” J. Phys. Chem. B, 115, 6616- 6622 (2011).

J303. M.V. Roux, G. Martín-Valcarcel, R. Notario, S. Kini, J.S. Chickos and J.F. Liebman “The Joining of Measurement and Prediction: The Enthalpy of Formation of 1,4-Cubanedicarboxylic Acid, J. Chem. Eng. Data, 56, 1220 – 1228 (2011). (This primary, invited, refereed research paper is in honor of John M. Prausnitz.)

J302. M. Maatallah, D. Cheraqaoui, A. Jarid and J.F. Liebman, “Are Closed Clusters Expected from the (n+1) Skeletal Electron Pairs Rule in Alanes and Gallanes? A DFT Structural Study of A H (A n n+2 = Al, Ga, and n = 4–6),” Polyhedron, 30, 1080 - 1084 (2011).