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Métodos Semi-Empíricos: princípios básicos e aplicaçõesSemi-Empirical Methods: basics principles and uses
(Universidade Estadual Paulista (Unesp), 2016)
Resonance Raman investigation and semi-empirical calculation of the natural carotenoid bixin
(1997)
A detailed resonance Raman investigation of the natural carotenoid bixin (6,6′-diapo-ψ-ψ′-carotenedioic acid monomethyl ester) was undertaken in chloroform solution. The excitation profiles of four fundamentals, one overtone ...
Estudio comparativo entre la capacidad de carga de pilotes excavados, estimados mediante métodos analíticos, semiempiricos y pruebas de carga. Aplicaciones en suelos gravosos y arcillosos en la costa del PerúComparative study between the load capacity of excavated piles, estimated by analytical, semi-empirical methods and load tests. Applications on gravel and clay soils on the coast of Peru
(Universidad Peruana de Ciencias Aplicadas (UPC)PE, 2020)
Polymeric ligand-metal acetate interactions: Spectroscopic study and semi-empirical calculations
(Sociedad Chilena de Química, 2005)
Métodos Semi-Empíricos: princípios básicos e aplicações
(Universidade Estadual Paulista (Unesp), 2015-12-18)
In this work we investigate the effects of the presence of heteroatoms on a “supercoronene” sheet (C58H18 molecule used as a molecular model for graphene). Specifically, we used the semiempirical method PM6 as implemented ...
A semi-empirical study on the electronic structure of ellipticines
(Elsevier Science BvAmsterdamHolanda, 1999)
Métodos Semi-Empíricos: princípios básicos e aplicações
(Universidade Estadual Paulista (UNESP), 2016)
Flammability limits temperature dependence of pure compounds in air at atmospheric pressure
(2017-01-01)
The objective of the present work is to study the temperature dependence of the flammability limits for pure compounds, and to develop a methodology to determine these limits in air at atmospheric pressure and at different ...