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The Fukui function is named after Kenichi Fukui, who investigated the frontier orbitals described by the function, specifically the HOMO and LUMO. [3] Fukui functions are related in part to the frontier molecular orbital theory (also known as the Fukui theory of reactivity and selection, also developed by Kenichi Fukui) which discusses how nucleophiles attack the HOMO while at the same time ...
Simulink is a MATLAB-based graphical programming environment for modeling, simulating and analyzing multidomain dynamical systems. Its primary interface is a graphical block diagramming tool and a customizable set of block libraries. It offers tight integration with the rest of the MATLAB environment and can either drive MATLAB or be scripted ...
Octave programs consist of a list of function calls or a script. The syntax is matrix-based and provides various functions for matrix operations. It supports various data structures and allows object-oriented programming. [26] Its syntax is very similar to MATLAB, and careful programming of a script will allow it to run on both Octave and ...
Since the exo-product has primary (bonding) orbital interactions, it can still form; but since the endo-product forms faster, it is the major product. [2] *Note: The HOMO of ethene and the LUMO of butadiene are both symmetric, meaning the reaction between these species is allowed as well. This is referred to as the "inverse electron demand ...
FEATool Multiphysics is a fully integrated physics and PDE simulation environment where the modeling process is subdivided into six steps; preprocessing (CAD and geometry modeling), mesh and grid generation, physics and PDE specification, boundary condition specification, solution, and postprocessing and visualization.
A MEX file is a type of computer file that provides an interface between MATLAB or Octave and functions written in C, C++ or Fortran.It stands for "MATLAB executable". When compiled, MEX files are dynamically loaded and allow external functions to be invoked from within MATLAB or Octave as if they were built-in functions.
The Church numeral n is a function that takes a function f as argument and returns the n-th composition of f, i.e. the function f composed with itself n times. This is denoted f ( n ) and is in fact the n -th power of f (considered as an operator); f (0) is defined to be the identity function.
The frequency domain decomposition (FDD) is an output-only system identification technique popular in civil engineering, in particular in structural health monitoring.As an output-only algorithm, it is useful when the input data is unknown.