Departamento de Química Física

1989

1. AB initio gradient optimized molecular geometry and conformational analysis of 1,2-propanediol at the 4-21G level

   Journal of Molecular Structure: THEOCHEM, Vol. 184, Núm. 3-4, pp. 323-342

2. Ab initio-gradient optimized molecular geometry and conformational analysis of 2-methoxyethanol at the 4-21G level

   Journal of Molecular Structure: THEOCHEM, Vol. 188, Núm. 1-2, pp. 95-104

3. An ab initio gradient study of trimethylhydrazine

   Journal of Molecular Structure: THEOCHEM, Vol. 184, Núm. 3-4, pp. 311-322

4. Decomposition of N-methyl-N-nitrosotoluene-p-sulphonamide in basic media: Hydrolysis and transnitrosation reactions

   Journal of the Chemical Society, Perkin Transactions 2, pp. 1861-1866

5. Fractal analysis of Brownian dynamics simulations of diffusion-controlled reactions

   Chemical Physics, Vol. 132, Núm. 1-2, pp. 83-89

6. Observations of transient temporal dissipative structures in microemulsions

   Journal of Non-Equilibrium Thermodynamics, Vol. 14, Núm. 3, pp. 287-292

7. Revision of the methodology in enzyme kinetics: A fractal approach

   Journal of Theoretical Biology, Vol. 139, Núm. 1, pp. 129-139

8. Short communication observations of spatial dissipative structures in microemulsions

   Journal of Non-Equilibrium Thermodynamics, Vol. 14, Núm. 3, pp. 279-297

9. Studies on internal nitroso group transfer. Nitrosation of thiomorpholine

   Journal of the Chemical Society, Perkin Transactions 2, pp. 1677-1680

10. Study of the geometric trends and rotational constants of 1-fluoro-2-propanol and 2-fluoropropanol by Ab Initio calculations

    Tetrahedron Computer Methodology, Vol. 2, Núm. 2, pp. 85-92