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Simulation of natural dyes adsorbed on TiO2for photovoltaic applications
(Elsevier Ltd, 2017)
The origin of photoluminescence in amorphous lead titanate
(Springer, 2003-03)
Condensation of the highest occupied molecular orbital within the electron localization function domains
(GURU NAK DEV UNIVERSITY, 2005)
Condensation of the highest occupied molecular orbital within the electron localization function domains
(GURU NAK DEV UNIVERSITY, 2005)
In pursuit of negative Fukui functions: examples where the highest occupied molecular orbital fails to dominate the chemical reactivity
(Springer, 2013)
In our quest to explore molecules with chemically
significant regions where the Fukui function is negative, we
explored reactions where the frontier orbital that indicates
the sites for electrophilic attack is not the ...
Agregados moleculares de pre-nucleación en la atmósfera
(2020)
Los mecanismos de formación de partículas atmosféricas desde la fase gaseosa todavía no han sido descriptos de forma satisfactoria. Dado el tamaño mínimo que los distingue y la consecuente inaccesibilidad experimental, los ...