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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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Example file tunneling_perpendicular.prj succesfully loaded
Web-Schrodinger 3.3
header
begin
date = a_datum
time = az_ido
end
mesh
begin
nx = 256
ny = 256
sx = 76.8
sy = 76.8
v0 = 0.0
end
pot
begin
pot = ( rectangle, 0.0, 0.0, 80.0, 2.7, 0.0, 7.0, 0.0, 0.0, 0.0, 0.0, 0.0 )
end
psi0
begin
xi = 0.0
yi = 18
ax = 5.0
ay = 5.0
ekin = 5.0
angle = -90.0
d1x = 0.0
d1y = 0.0
d2x = 0.0
d2y = 0.0
bx = 0.0
by = 0.0
end
detectors
begin
detector = ( horizontal, -40, 40, 3 )
detector = ( horizontal, -40, 40, -3.9 )
end
parameters
begin
nt = 541
dt = 0.2
ki_rho = 20
nstat = 3
end
