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Simulation of natural dyes adsorbed on TiO2for photovoltaic applications
(Elsevier Ltd, 2017)
Molecular orbital calculations of hydrogen bonding in ammonia - Formic acid system in the presence of electric fields
(2004)
The effects of electric fields on hydrogen bonding in ammonia-formic acid system, are examined with STO-3G and 6-31 G(d) wavefunctions. This system was used in a previous work to model hydrogen bonding in crystalline amino ...
Orbitals in general chemistry, Part II: Mathematical Realities
(2021)
In Part II of a three-part series, we discuss two factors absent from textbooks of general chemistry that are important in a discussion
of teaching orbitals. First, atomic orbitals are shown systematically to comprise ...
Molecular Orbital Calculations of Hydrogen Bonding in Ammonia - Formic Acid System in the Presence of Electric Fields
(Sociedad Chilena de Química, 2004)
A semiempirical quantum mechanical approach towards understanding of cyclopropenone reactivity
(Elsevier Science BvAmsterdamHolanda, 1996)