ITHES 25084
INSTITUTO DE TECNOLOGIAS DEL HIDROGENO Y ENERGIAS SOSTENIBLES
Unidad Ejecutora - UE
congresos y reuniones científicas
Título:
A first-principles modeling of glycerol and ammonia interactions on the cation-deficient VSbO4(110) surface
Autor/es:
IGNACIO ALLIATI; BEATRIZ IRIGOYEN
Lugar:
Málaga
Reunión:
Simposio; 8th International Symposium on Group Five Elements; 2014
Institución organizadora:
Group Five Elements
Resumen:
Our calculations show that, on the cation-deficient VSbO4(110) surface, glycerol and ammonia interactions on Lewis sites are more favorable than on Brønsted sites. Glycerol preferentially adsorbs with its terminal and central hydroxyl groups pointing to Sb1 and V1 cations, respectively; while ammonia is activated on Sb2 sites.
