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Sergio Rojas

Publications and source records attributed to Sergio Rojas.

3 recordsLinked to original sources

Silylation of a Co/SiO2 catalyst. Characterization and exploitation of the CO hydrogenation reaction.

Several silylated- and nonsilylated Co/SiO2 catalysts have been prepared by reaction of the surface silanol groups with hexamethyldisilazane (HMDS). These samples have been characterized by means of N2 adsorption isotherms, solid-state nuclear magnetic resonance (29Si and 1H), X-ray photoelectron spectroscopy, thermogravimetric analysis, and diffuse reflectance IR spectroscopy. We have focused on the study of the silylated surface stability at high temperatures and in different atmospheres. The characterization techniques have shown that silica silylation after cobalt impregnation leads to a silylated SiO2 surface composed of hydrophobic Si-(CH3)3 species highly stable up to 600-650 K in both oxidizing and reducing atmospheres. However, X-ray diffraction and temperature-programmed reduction have shown that the hydrophobic nature of the silica surface does not affect the metal dispersion and its reducibility. The materials prepared in this way have been tested as catalysts for the Fischer-Tropsch synthesis reaction. The CO conversion reaction rate increased over the silylated catalyst, probably as a consequence of the higher number of available active sites because water adsorption over the catalyst surface is impeded. However, catalyst deactivation was not affected by the hydrophobic nature of the support, suggesting that carbon deposition is the more probable mechanism of cobalt-based catalyst deactivation during the Fischer-Tropsch synthesis.

Journal Article↗

A pyrimidine thiolate Rh(I) complex: structure, bonding and one-dimensional interactions in solid and in solution.

The reaction of [Rh(micro-Cl)(COD)]2 with 4,6-dimethyl-pyrimidinethiolate (Me2-pymt) and subsequent substitution of COD by CO yields [Rh(Me2-pymt)(CO)2]. The stacking pattern found in this compound is in contradiction with previously studied comparable square-planar complexes of type d8-[M(chelate)(monodentate)2] in which each ligand has different pi-acidic character. A theoretical study of the intermolecular interactions and conformation of the title compound has been carried out, combining semi-empirical band calculations on the real chains and ab initio(MP2 level) calculations on a model dimer. The combination of electronic and steric effects determines the rotation of the successive monomers and the deviation from linearity of the one-dimensional stacks. Its behaviour in solution is also special, developing a blue colour and forming micelles, when adding water to acetone solutions.

Journal Article↗

Computer-assisted secondary reconstruction of unilateral posttraumatic orbital deformity.

Until now, computer-assisted surgery has not been practiced as part of the surgical routine of posttraumatic orbital reconstruction. The purpose of this study was to investigate the use of a navigation system for computer-assisted preoperative planning with virtual reconstruction to obtain symmetry of the orbits and intraoperative control of virtual contours in comparison with the clinically achieved surgical results. A further objective of the computer-assisted orbital analysis was to use an ideal measurement for the two-dimensional and three-dimensional changes following orbital reconstruction and to check the equality of the postoperative values for the affected orbits in comparison with those of the unaffected sides. Patients with unilateral posttraumatic orbital defects (n = 18) underwent computer-assisted surgery and preoperative planning using a spiral computed tomography database. Surgical procedures were preplanned with virtual correction by mirroring an individually defined three-dimensional segment from the unaffected side onto the deformed side, creating an ideal unilateral reconstruction. These computer-models were intraoperatively used as virtual templates to navigate the preplanned contours and the globe projection using the Stryker-Leibinger navigation system. Individual noninvasive registration with an overall inaccuracy of approximately 1 mm was achieved by using a maxillary occlusal splint with four markers. The mirroring of the unaffected side allowed an ideal virtual reconstruction. A mean decrease in enlarged orbital volume of 4.0 (SD +/- 1.9) cm was achieved, as was a mean increase in the sagittal globe projection of 5.88 (SD +/- 2.98) mm. With a paired Student test, the decrease between the preoperative and postoperative differences of the affected and unaffected sides was proved significant for orbital volume, globe projection, and computed tomography-based Hertel scale changes (p < 0.01). In 15 of 18 cases, simultaneous malar bone advancement resulted primarily in an additional increase in orbital volume before intraorbital augmentation with calvarial split-bone grafts could be performed. Intraorbital bony augmentation included one (n = 1), two (n = 7), three (n = 8), and all four (n = 2) orbital walls. Computer-assisted preoperative planning enables the surgeon to predict reconstructive surgical steps before the operation. Highly vulnerable structures such as the optic nerve can be detected and avoided intraoperatively, and virtually preplanned bone graft positions and/or orbital frame contours can be checked. Computer-assisted preoperative planning and surgery thus advance the difficult surgical field of orbital reconstruction, particularly through a greater exploitation of radiologic information without additional radiation to the patient.

Adolescent↗