P(r) function calculator
This Javascript calculates the distance-distribution function of models consisting of up to 8 spheres with the same radius and optionally different electron densities and different x/y/z coordinates using the Debye-formula in real space. Enter the number of spheres, their common radius R, their coordinates x(i), y(i), z(i) and their electron-densities c(i). For N points the p(r) function or optionally the gamma(r) function from r = 0 to rmax with a scaling factor f will be calculated. The values are listed in r vs p(r) or vs gamma(r) in arbitrary units and can be copied and pasted from the window into any text-file for further processing and graphical displaying.
Input
p(r)
action
R
rmax
n
f
x(1)
y(1)
z(1)
c(1)
x(2)
y(2)
z(2)
c(2)
x(3)
y(3)
z(3)
c(3)
x(4)
y(4)
z(4)
c(4)
x(5)
y(5)
z(5)
c(5)
x(6)
y(6)
z(6)
c(6)
x(7)
y(7)
z(7)
c(7)
x(8)
y(8)
z(8)
c(8)
spheres
8
7
6
5
4
3
2
1
p(r)
g(r)
R
_{g}
p(r)-plot
Author:
M.Kriechbaum
, TU-Graz (2012), e-mail:
manfred.kriechbaum@tugraz.at