Authors:
Ventura, ON
Kieninger, M
Denis, PA
Cachau, RE
Citation: On. Ventura et al., Density functional computational thermochemistry: Isomerization of sulfineand its enthalpy of formation, J PHYS CH A, 105(43), 2001, pp. 9912-9916
Authors:
Kremer, C
Melian, C
Torres, J
Juanico, MP
Lamas, C
Pezaroglo, H
Manta, E
Schumann, H
Pickardt, J
Girgsdies, F
Ventura, ON
Lloret, F
Citation: C. Kremer et al., Synthesis, structure and magnetic properties of Mn(II) and Cu(II) complexes with the dicyano-acetic acid methyl ester anion, INORG CHIM, 314(1-2), 2001, pp. 83-90
Citation: Pa. Denis et On. Ventura, Density functional investigation of atmospheric sulfur chemistry II. The heat of formation of the XSO2 radicals X = H, CH3, CHEM P LETT, 344(1-2), 2001, pp. 221-228
Citation: Pa. Denis et On. Ventura, Density functional investigation of atmospheric sulfur chemistry. I. Enthalpy of formation of HSO and related molecules, INT J QUANT, 80(3), 2000, pp. 439-453
Authors:
Ventura, ON
Kieninger, M
Cachau, RE
Suhai, S
Citation: On. Ventura et al., Density functional computational thermochemistry: determination of the enthalpy of formation of sulfine, CH2=S=O, at room temperature, CHEM P LETT, 329(1-2), 2000, pp. 145-153
Citation: On. Ventura et al., Density functional theory is more accurate than coupled-cluster theory in the study of the thermochemistry of species containing the F-O bond, J PHYS CH A, 103(1), 1999, pp. 147-151
Authors:
Estiu, G
Rama, J
Pereira, A
Cachau, RE
Ventura, ON
Citation: G. Estiu et al., A theoretical study of excited state proton transfer in 3-hydroxychromone and related molecules, THEOCHEM, 487(3), 1999, pp. 221-230
Authors:
Gambino, D
Kremer, E
Baran, EJ
Mombru, A
Suescum, L
Mariezcurrena, R
Kieninger, M
Ventura, ON
Citation: D. Gambino et al., Synthesis, characterization, and crystal structure of [ReO(Me(4)tu)(4)](PF6)(3) (tu = thiourea), Z ANORG A C, 625(5), 1999, pp. 813-819
Citation: On. Ventura et al., Density functional and coupled-cluster calculations of isodesmic reactionsinvolving fluorine oxides, CHEM P LETT, 301(3-4), 1999, pp. 331-335
Citation: On. Ventura et M. Kieninger, Computational chemistry as an analytical tool: thermochemical examples in atmospheric chemistry, PUR A CHEM, 70(12), 1998, pp. 2301-2307