script para aplicacoes de efeitos visuais e funcionalidades de consulta International Database of Educational Objects

Ranking

Statistical Summary

Statistical Summary

Title: Gaussian approximations to 1s slater-type orbitals
Type of Resource: Animação/simulação
Objective: This demonstration represents the simplest 1s slater-type orbitals
Abstract: In this Demonstration the red curve represents the simplest 1s STO. The black curve represents its approximation by a superposition of n=1 , 2, or 3 Gaussians, designated STO-nG basis functions, with n=1,2,3. You can vary the exponential parameters α1,α2, and α3 to maximize the integral S (the overlap between the STO and its Gaussian approximation) with a maximum attainable value S=1. You can plot either the orbital function Φ(r) or the radial distribution function (RDF)4πr²Φ(r)²
Observation: This demonstration needs MathematicaPlayer.EXE to run found in http://objetoseducacionais2.mec.gov.br/handle/mec/4737
Curriculum Component: Educação Superior::Ciências Exatas e da Terra::Física
Theme: Educação Superior::Ciências Exatas e da Terra::Física::Teorias Específicas e Modelos de Interação; Sistemática de Partículas; Raios Cósmicos
Author: Blinder, S M
Language: English (en)
Country: United States (us)
Description: Knowledge in orbital's theory
Web Address: http://demonstrations.wolfram.com/GaussianApproximationsTo1sSlaterTypeOrbitals/
Date: 2008
Rightsholder: The Wolfram Demonstrations Project & Contributors
License: Demonstration freeware using Mathematica Player
Submitter: Universidade Federal de São Carlos (UFSCAR)
URI: http://objetoseducacionais2.mec.gov.br/handle/mec/9355
This Educational Object appears in the following Types of resources: Educação Superior: Ciências Exatas e da Terra: Física: Animações/Simulações