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Scattering example ipynb
2020-06-23
Ma
r
e
k
Nečada
Scatterin
g
exa
m
ple ip
y
nb
commit
|
commitdiff
|
tree
2020-06-23
Mare
k
N
e
čada
s
ize_vs_lMax
p
lot script
as
in the p
a
per
commit
|
commitdiff
|
tree
2020-06-23
Marek Nečad
a
Add the size
v
s
.
lMax
script fr
o
m
triton
.
commit
|
commitdiff
|
tree
2020-06-23
Mare
k
Nečada
S
q
uare lattice exam
p
le
mode plot
commit
|
commitdiff
|
tree
2020-06-22
Marek Nečada
Ewald 1,2D
i
n 3D f
i
x K ->
k +
K
commit
|
commitdiff
|
tree
2020-06-22
Marek Ne
č
ada
E
w
a
ld 1D and 2D in 3D
notes formulae linewraps
commit
|
commitdiff
|
tree
2020-06-22
M
arek
N
e
čada
1D and
2D in 3D notes before
typeset
t
in
g
c
h
anges
commit
|
commitdiff
|
tree
2020-06-21
M
a
r
ek Nečada
Generic 1D _and_ 2
D
in 3D LR Ewald
f
o
rmula
commit
|
commitdiff
|
tree
2020-06-21
Marek Nečada
K
i
nd
a
reaso
n
able
form of
1D in 3D Ewald
.
commit
|
commitdiff
|
tree
2020-06-15
Marek Nečada
E
w
ald 1D in 3D
:
jdu spát
commit
|
commitdiff
|
tree
2020-06-15
Marek Nečada
W
IP Ewald 1D in 3D notes:
partial i
n
dex fix etc
.
commit
|
commitdiff
|
tree
2020-06-14
Marek Nečada
WI
P
Ewald 1D in 3D
commit
|
commitdiff
|
tree
2020-06-12
Mar
e
k Nečada
Ew
a
ld
1
D in 3D notes
commit
|
commitdiff
|
tree
2020-06-12
M
a
r
e
k Neča
d
a
Notes on τ vs
.
σ
commit
|
commitdiff
|
tree
2020-06-11
Mar
e
k Nečad
a
N
o
tes:
periodic
Greens functions vs SWF lattice sums
commit
|
commitdiff
|
tree
2020-06-07
Mare
k
N
ečada
WIP examples
commit
|
commitdiff
|
tree
2020-06-06
Marek Nečada
W
IP he
x
arra
y
modes
ex
a
mple
commit
|
commitdiff
|
tree
2020-06-04
M
a
r
ek Ne
č
ada
Notes
commit
|
commitdiff
|
tree
2020-06-01
Marek
N
ečada
Do
n
't pass XYONLY fl
a
g when
i
t's n
o
t
X
YONLY
commit
|
commitdiff
|
tree
2020-05-31
Marek Nečada
E
v
aluate s
c
attered
e
le
c
t
ric field
s
in 2d-periodic sys
t
em
.
commit
|
commitdiff
|
tree
2020-05-31
M
arek Neč
a
da
PGen_shi
f
ted sh
i
fted p
o
i
n
t metag
e
nerator
commit
|
commitdiff
|
tree
2020-05-30
Ma
r
e
k Ne
č
ada
Constant factors in gene
r
al
(
off-plane) Ewa
l
d
2D-
i
n
.
.
.
commit
|
commitdiff
|
tree
2020-05-29
Marek Neč
a
da
WIP
E
w
ald 2D
i
n 3D genera
l
z != 0
c
on
s
tan
t
factors
.
commit
|
commitdiff
|
tree
2020-05-28
Marek Nečada
B
ranch selection fo
r
Δ_n in Ew
a
l
d
sum
commit
|
commitdiff
|
tree
2020-05-27
Marek Nečada
Implemen
t
ation of the Δ_n factor as a seri
e
s
;
error
.
.
.
commit
|
commitdiff
|
tree
2020-05-26
Marek Ne
č
ada
Fix
s
ign
s
i
n the latt
i
ce
s
um Delt
a
(
recurrent formu
l
a)
commit
|
commitdiff
|
tree
2020-05-26
Marek Neč
a
da
N
otes on ev
a
luating Δ_n fact
o
r in
the
l
attice
s
ums
.
commit
|
commitdiff
|
tree
2020-05-22
Marek Nečada
Wrap
p
ers for t
e
s
ting z !=
0 latti
c
e s
u
m related
s
pec
i
al
.
.
.
commit
|
commitdiff
|
tree
2020-05-19
Marek Nečada
WIP 2D-in-3D Ewald s
u
m for z != 0
commit
|
commitdiff
|
tree
2020-05-19
Ma
r
ek Nečada
long double literals instead of doubles
commit
|
commitdiff
|
tree
2020-05-19
M
arek
Nečada
C
M
ak
e
Lists for F
a
ddeeva
commit
|
commitdiff
|
tree
2020-05-04
Ma
r
ek
Nečada
Slic
e
d
arr
a
y drivi
n
g in finiter
e
ctlat-con
s
tant-driving
.
py
commit
|
commitdiff
|
tree
2020-05-03
Marek
Neč
a
da
"slice" argument type in argproc
.
p
y
commit
|
commitdiff
|
tree
2020-04-28
Marek Nečada
Fix
r
eciprocal basis
(trans
p
osition) in
a
r
gproc
.
py
commit
|
commitdiff
|
tree
2020-04-28
Marek Nečada
Plot emp
t
y l
a
tti
c
e m
o
de
s
in lat2d_
r
ealfreqsvd
.
py
commit
|
commitdiff
|
tree
2020-04-27
Marek
N
ečada
He
x
ex
a
mple fix K
poi
n
t posi
t
i
o
n;
a
dd real freq SVD
commit
|
commitdiff
|
tree
2020-04-26
Marek Nečada
Adjust eta for each (omega, k) pa
i
r
t
o
pr
e
vent hi-freq
.
.
.
commit
|
commitdiff
|
tree
2020-04-26
M
a
r
e
k
Ne
č
a
d
a
Move
MIN,MAX,SQ mac
r
os
t
o
a
common
h
e
ader
commit
|
commitdiff
|
tree
2020-04-22
Marek Nečada
Separate Ewald param
e
ter for di
f
ferent
f
r
e
quencies
commit
|
commitdiff
|
tree
2020-04-21
Marek N
e
ča
d
a
Ex
p
os
e
Ewald
p
aramete
r
t
o
Py
t
hon
commit
|
commitdiff
|
tree
2020-04-21
Ma
r
ek
Nečada
SVD interval f
o
r general 2D lattice
commit
|
commitdiff
|
tree
2020-04-20
Marek Ne
č
a
da
Scatter
i
ngSystem: docs
t
rings, avoid crash o
n
un
d
e
r
flow
commit
|
commitdiff
|
tree
2020-04-13
Ma
r
ek Nečada
M
o
re gene
r
a
l s
c
ript fo
r
2
D
lattice m
o
des
.
commit
|
commitdiff
|
tree
2020-04-12
Marek Nečada
Fix inval
i
d po
i
nter
i
n
pairwi
s
e tran
s
la
t
i
o
n matr
i
x
.
commit
|
commitdiff
|
tree
2020-04-12
Ma
r
ek Nečada
WIP argproc mu
l
tiparti
c
le; update mi
s
c scr
i
pts
commit
|
commitdiff
|
tree
2020-04-11
Marek Nečada
F
i
x
e
i
genvalue matri
x
dimensio
n
s
i
n
Beyn
.
commit
|
commitdiff
|
tree
2020-04-11
Marek N
e
čada
F
i
x syntax e
r
ro
r
which gc
c
tolera
t
ed
commit
|
commitdiff
|
tree
2020-04-11
M
a
rek Ne
č
a
da
Dummy CPU n
u
m
ber hack for
s
ystem
s
wi
t
hout the
s
y
s
conf
.
.
.
commit
|
commitdiff
|
tree
2020-04-10
Marek Neča
d
a
M
ore multipla
t
f
orm build of camos
commit
|
commitdiff
|
tree
2020-04-10
Ma
r
ek Ne
č
ada
Quit F
o
rtr
a
n dependenci
e
s, using ow
n
f2c'd version
.
.
.
commit
|
commitdiff
|
tree
2020-04-07
Marek Nečad
a
BaseSpec __eq__() and __hash__(
)
commit
|
commitdiff
|
tree
2020-04-05
Marek Nečada
Infinite rect
l
attices script multipl
e
freqs etc
.
commit
|
commitdiff
|
tree
2020-04-04
Marek Nečada
More cdefs
from v
e
ctors
.
h
commit
|
commitdiff
|
tree
2020-04-04
Marek Nečada
Fix
c
ritica
l
bug
i
n qp
m
s_vecsph
a
rm_fill()
commit
|
commitdiff
|
tree
2020-04-03
Marek Nečada
Some little docstrings
.
commit
|
commitdiff
|
tree
2020-04-02
Ma
r
ek Nečada
A
r
g
proc: wa
v
es w
i
th p
o
larisation; update fi
n
i
t
ere
c
tlat
.
.
.
commit
|
commitdiff
|
tree
2020-03-29
Marek Nečada
Fix axes in finitere
c
tlat-
c
onstant-
d
riving
.
py plots
commit
|
commitdiff
|
tree
2020-03-27
Marek Nečada
Make infin
i
te rect lat
.
/ real freq
.
SVD w
o
rk with
.
.
.
commit
|
commitdiff
|
tree
2020-03-27
M
a
rek Nečada
Rectangular
lattic
e
S
VD
c
u
t
a
t
gamma po
i
nt, real freq
u
ency
commit
|
commitdiff
|
tree
2020-03-26
Marek Nečada
finiterectlat-co
n
st
a
n
t
-driving:
di
s
pl
a
y re
a
l x, y dipoles
commit
|
commitdiff
|
tree
2020-03-26
M
a
r
e
k
N
ečada
Vari
o
us
fixes to finiterectla
t
-constant-driving
.
p
y
commit
|
commitdiff
|
tree
2020-03-26
Marek Ne
č
ada
Finite
r
ect lat
cons
t
a
nt dr
i
v
i
n
g far field "c
c
d"
commit
|
commitdiff
|
tree
2020-03-26
M
arek Neč
a
da
Avoid u
s
ing S
t
e
a
d metho
d
f
r
om GSL a
b
ove certain threshold
.
commit
|
commitdiff
|
tree
2020-03-26
M
a
rek Ne
č
ada
Cleanup: eliminate b
a
re abort()
s
commit
|
commitdiff
|
tree
2020-03-23
Marek Nečada
Doxygenise qpms_error
.
h
commit
|
commitdiff
|
tree
2020-03-23
M
a
rek Nečada
Finer
error handlin
g
.
commit
|
commitdiff
|
tree
2020-03-23
Ma
r
ek Neč
a
da
Re
p
lac
e
a
bor
t
() c
a
lls with
custom macr
o
s in v
s
wf
.
c
commit
|
commitdiff
|
tree
2020-03-23
Mar
e
k Nečada
Allow di
f
f
e
rent Bessel
kin
d
in scatte
r
e
d_E
commit
|
commitdiff
|
tree
2020-03-21
M
a
r
ek
N
e
čada
Upd
a
te test program
s
to cu
r
rent A
P
I
.
commit
|
commitdiff
|
tree
2020-03-21
Marek Nečada
Alternative im
p
lementation of qpm
s
_scatsys_scattered_E()
commit
|
commitdiff
|
tree
2020-03-21
Marek Ne
č
ada
Fix
a
llocat
e
d a
r
ray sizes
.
commit
|
commitdiff
|
tree
2020-03-21
Marek Neča
d
a
Scatsystem
scattered E field
methods
commit
|
commitdiff
|
tree
2020-03-18
M
arek Nečada
F
o
u
r
ier pl
o
ts to fini
t
erectlat-co
n
stant-driving
.
p
y
commit
|
commitdiff
|
tree
2020-03-18
Mar
e
k
N
ečada
Better plo
t
s fo
r
fini
t
e
r
ec
t
l
a
t-c
o
n
s
tant-driving
.
p
y
commit
|
commitdiff
|
tree
2020-03-18
Ma
r
ek
N
ečada
Fix ScatteringSystem
.
f
ullvec_poffset
s
commit
|
commitdiff
|
tree
2020-03-18
Mar
e
k Ne
č
ada
Reduce tolerances
a
s
a
workaround
f
or inpr
e
cise in
t
egrati
o
n
.
commit
|
commitdiff
|
tree
2020-03-18
Marek Nečada
"Con
s
t
ant per-particl
e
d
r
iving" si
m
ulation
s
cript
commit
|
commitdiff
|
tree
2020-03-13
Mar
e
k Nečada
Mi
n
or a
d
ditions
t
o
docs
.
commit
|
commitdiff
|
tree
2020-03-11
Marek Nečada
Remove pre-Ewald lattice
s
um related "spl
i
t-Bessel
.
.
.
commit
|
commitdiff
|
tree
2020-03-10
Marek Nečada
F
i
x cython declarations
.
commit
|
commitdiff
|
tree
2020-03-09
Marek Nečada
xy-pe
r
iodic
l
attice Beyn algorit
h
m
support in Scatterin
g
System
commit
|
commitdiff
|
tree
2020-03-06
Marek Nečada
xy-period
i
c lattice
s
catter
i
ng su
p
por
t
in ScatteringSystem
commit
|
commitdiff
|
tree
2020-02-28
Marek Nečada
WI
P
cy
t
hon sup
p
ort for periodic lattice
s
commit
|
commitdiff
|
tree
2020-02-28
Marek Neča
d
a
S
crap the
ss
-
>
per flexible
array thin
g
t
o
avoid excess
i
ve
.
.
.
commit
|
commitdiff
|
tree
2020-02-28
Marek Nečada
Beyn wrappers
for
periodic system
.
commit
|
commitdiff
|
tree
2020-02-28
Ma
r
ek Nečad
a
s
cat
s
yste
m
: mode p
r
oble
m
ma
t
rix fo
r
xy-plane pe
r
io
d
ic
.
.
.
commit
|
commitdiff
|
tree
2020-02-27
Ma
r
ek Nečada
WIP 2D in 3D -
p
eri
o
dic sca
t
system
commit
|
commitdiff
|
tree
2020-02-25
Marek N
e
čada
General
h
e
a
p-
b
as
e
d
l
at
t
ic
e
point
generator compiles
.
.
.
commit
|
commitdiff
|
tree
2020-02-25
Marek Nečada
WI
P
Bin
a
ry-heap
b
ased arbitrary
-
dimens
i
onal lattice
.
.
.
commit
|
commitdiff
|
tree
2020-02-14
Marek Nečad
a
Experimenta
l
support f
o
r peri
o
dic lattices in s
c
a
t
sys
.
.
.
commit
|
commitdiff
|
tree
2020-02-14
Marek Nečada
Move periodic lattice-rel
a
t
ed st
u
ff into a separate
.
.
.
commit
|
commitdiff
|
tree
2020-02-13
M
ar
e
k Nečada
New members
to qpms_scatsys_t for periodi
c
lat
t
ices
.
commit
|
commitdiff
|
tree
2020-02-13
Mare
k
Neča
d
a
s
u
pport f
o
r
TMat
r
ixI
n
terpolator in TMatrixGenerator
commit
|
commitdiff
|
tree
2020-02-04
Marek Nečada
Irr
e
p-d
e
composed scatsy
s
beyn; fix
m
issing Finite
P
ointGroup
.
.
.
commit
|
commitdiff
|
tree
2020-02-04
Marek Nečada
Bey
n
algorithm cython wrapper (finite systems)
commit
|
commitdiff
|
tree
2020-02-04
M
arek Nečada
Beyn
w
rappe
r
s
for
f
init
e
system, doxygen
commit
|
commitdiff
|
tree
2020-02-04
Marek Ne
č
ada
Beyn algorithm "cherry-pick" fro
m
'ne
w
bey
n
_unitcell'
commit
|
commitdiff
|
tree
2020-02-04
M
arek Nečada
Fix fini
t
e
rect
l
a
t-m
o
des
.
p
y
obvious error
s
.
commit
|
commitdiff
|
tree
2020-02-04
Marek Nečada
Simple finite řectangular lattic
e
mo
d
e search script
commit
|
commitdiff
|
tree
2020-02-04
Mar
e
k
N
ečada
Avoi
d
tmgen multi
p
licities
(
-
>
s
l
o
w
down
)
in Sca
t
t
eri
n
gS
y
stem
.
.
.
commit
|
commitdiff
|
tree
next