The Quitel-2002 Oscar N. VenturaMarco Antonio Chaer NascimentoJulián Echave OriginalPaper 04 December 2003 Pages: 359 - 359
Rayleigh and Raman light scattering in hydrogen-bonded acetonitrile–water Eduardo RissiEudes E. FiletiSylvio Canuto OriginalPaper 01 December 2003 Pages: 360 - 366
Self-consistent-field – Hartree–Fock method with finite nuclear mass corrections Cristina P. GonçalvesJosé R. Mohallem OriginalPaper 27 November 2003 Pages: 367 - 370
New structural parameters of fullerenes for principal component analysis F. Torrens OriginalPaper 01 December 2003 Pages: 371 - 376
Theoretical study of the gas-phase thermolysis reaction of alkyl (ethyl, isopropyl, and tert-butyl) N,N-dimethylcarbamates and N,N-diethylcarbamates Camilo QuijanoRafael NotarioEderley Vélez OriginalPaper 25 November 2003 Pages: 377 - 386
A density functional theory study of the gas-phase elimination reactions of 4-arylideneimino-1,2,4-triazol-3(2H )-ones and their 3(2H )-thione analogues Luis A. LeónRafael NotarioNouria Al-Awadi OriginalPaper 26 November 2003 Pages: 387 - 394
Exact and approximate forms of the kinetic energy functional T s[ρ] for molecules obtained via local-scaling transformations Eduardo V. LudeñaValentin V. KarasievPedro Nieto OriginalPaper 29 November 2003 Pages: 395 - 402
New isospectral generalized potentials J. MoralesJ. J. PeñaA. Rubio-Ponce OriginalPaper 01 December 2003 Pages: 403 - 409
Immiscible fluid flow through nanotubes J. Marañón Di LeoJ. Marañón OriginalPaper 25 November 2003 Pages: 410 - 413
Theoretical study of the adsorption of oxygen on a Cu(100) surface and the coadsorption with alkali atoms Luis Padilla-CamposPatricio Fuentealba OriginalPaper 25 November 2003 Pages: 414 - 420
The maximum hardness and minimum polarizability principles as the basis for the study of reaction profiles B. GómezP. FuentealbaR. Contreras OriginalPaper 25 November 2003 Pages: 421 - 427
Rationalization of the optical rotatory power of chiral molecules into atomic terms: a study of N2H4 M. P. Béccar VarelaM. B. FerraroD. Rial OriginalPaper 10 October 2003 Pages: 428 - 433
Synthesis of anticonvulsant sulfamides. Theoretical study of the related mechanism Luciana GavernetHebe Saraví Saraví CisnerosGguillerminal L. Estiú OriginalPaper 25 November 2003 Pages: 434 - 440
Theoretical study on reactions catalyzed by gallium-substituted zeolites Márcio Soares PereiraMacro Antonio Chaer Nascimento OriginalPaper 03 December 2003 Pages: 441 - 445
Transferable group contributions for a variety of chemical phenomena and compounds G. AlagonaS. CampanileS. Monti OriginalPaper 25 November 2003 Pages: 446 - 459
Monte Carlo study of three-dimensional organization of water molecules around DNA fragments E. GonzálezA. DeriabinaV. I. Poltev OriginalPaper 25 November 2003 Pages: 460 - 465
Caffeine interactions with nucleic acids. Molecular mechanics calculations of model systems for explanation of mechanisms of biological actions V. I. PoltevT. I. GrokhlinaE. González OriginalPaper 25 November 2003 Pages: 466 - 472