?? cluster_init.m
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function X = cluster_init(N,a,b,g)
% X = cluster_init(N,a,b,g) ;
% Method for chemcluster example supplied with SA Tools.
% See http://www.frostconcepts.com/software for information on SA Tools.
%
% X = cluster_init ;
% X = cluster_init(N) ;
% X = cluster_init(N,a,b) ;
% X = cluster_init(N,a,b,g) ;
%
% X = [N,a,b,g,rho]
% N = number of molecules
% a = Lennard-Jones coefficient
% b = Lennard-Jones coefficient
% g = compression factor used in perturb
% rho = (b/a)^(1/6) two-particle 1d solution
%
% Sets and stores parameters for Lennard-Jones simulation.
% a and b must be positive scalars.
% g must be a positive scalar, typically < 1.
% Execute without arguments to determine default values.
%
if nargin < 4 % set default values of parameters as needed
g = .97 ;
if nargin < 3
a = 4 ;
b = 3 ;
if nargin < 1
N = 7 ;
end
end
end
rho = (b/a)^(1/6) ; % compute for later use
X = [N,a,b,g,rho] ;
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