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Web-Schrödinger 3.31
(C)2007-2022 G. I. Márk, Ph. Lambin, L. P. Biró, EK MFA Budapest,Hungary -- Uni Namur, Belgium
www.nanotechnology.hu
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Web-Schrodinger 3.3
header
begin
date = a_datum
time = az_ido
end
mesh
begin
nx = 128
ny = 128
sx = 10
sy = 10
v0 = 0
end
pot
begin
pot = ( circle, -1.5, 0.0, 1.6, -3.0, 0.0, 0.0 )
pot = ( circle, 1.5, , 1.6, -3, , )
pot = ( circle, -1.5, 0.0, 1.4, -31, 20, )
pot = ( circle, 1.5, 0.0, 1.4, -31, 20, )
pot = ( circle, -1.5, 0.0, 0.7, -52, 50, )
pot = ( circle, 1.5, 0.0, 0.7, -52, 50, )
end
psi0
begin
xi = 0.0
yi = 0.0
ax = 3.0
ay = 3.0
ekin = 0.0
angle = 0.0
d1x = 0.0
d1y = 0.0
d2x = 0.0
d2y = 0.0
bx = 0.0
by = 0.0
end
detectors
begin
end
parameters
begin
nt = 401
dt = 0.8
ki_rho = 20
nstat = 6
end
