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github.com/SINGROUP/dscribe
/ functions
Functions
2,448 in github.com/SINGROUP/dscribe
⨍
Functions
2,448
◇
Types & classes
31
↳
Endpoints
3
Function
later
()
docs/0.4.x/_static/underscore-1.3.1.js:533
Function
later
()
docs/1.0.x/_static/underscore-1.3.1.js:533
Function
later
()
docs/0.3.x/_static/underscore-1.3.1.js:533
Function
later
()
docs/1.1.x/_static/underscore-1.12.0.js:1089
Function
later
()
docs/1.2.x/_static/underscore-1.13.1.js:1104
Method
lengths
(self)
dscribe/core/lattice.py:89
Function
load_gto_coefficients
(args)
tests/test_soap.py:231
Function
load_polynomial_coefficients
(args)
tests/test_soap.py:237
Function
lr
(n,r,t)
docs/1.1.x/_static/underscore.js:6
Function
m
(a)
docs/0.4.x/_static/underscore.js:29
Function
m
(a)
docs/1.0.x/_static/underscore.js:29
Function
m
(a)
docs/0.3.x/_static/underscore.js:29
Function
mapObject
(obj, iteratee, context)
docs/1.1.x/_static/underscore-1.12.0.js:761
Function
mapObject
(obj, iteratee, context)
docs/1.2.x/_static/underscore-1.13.1.js:761
Method
matrix
Copy of matrix representing the Lattice
dscribe/core/lattice.py:51
Function
me
()
docs/2.1.x/_static/jquery.js:2
Function
me
()
docs/0.4.x/_static/jquery.js:2
Function
me
()
docs/1.0.x/_static/jquery.js:2
Function
me
()
docs/0.3.x/_static/jquery.js:2
Function
me
()
docs/1.1.x/_static/jquery.js:2
Function
me
()
docs/1.2.x/_static/jquery.js:2
Function
me
()
docs/2.0.x/_static/jquery.js:2
Function
memoize
(func, hasher)
docs/1.1.x/_static/underscore-1.12.0.js:1056
Function
memoize
(func, hasher)
docs/1.2.x/_static/underscore-1.13.1.js:1071
Function
min
(obj, iteratee, context)
docs/1.2.x/_static/underscore-1.13.1.js:1492
Function
ne
(e,t)
docs/2.1.x/_static/jquery.js:2
Function
ne
(e,t)
docs/0.4.x/_static/jquery.js:2
Function
ne
(e,t)
docs/1.0.x/_static/jquery.js:2
Function
ne
(e,t)
docs/0.3.x/_static/jquery.js:2
Function
ne
(e,t)
docs/1.1.x/_static/jquery.js:2
Function
ne
(e,t)
docs/1.2.x/_static/jquery.js:2
Function
ne
(e,t)
docs/2.0.x/_static/jquery.js:2
Function
next
()
docs/0.4.x/_static/jquery-3.5.1.js:4584
Function
next
()
docs/1.0.x/_static/jquery-3.5.1.js:4584
Function
next
()
docs/0.3.x/_static/jquery-3.5.1.js:4584
Function
next
()
docs/1.1.x/_static/jquery-3.5.1.js:4584
Function
next
()
docs/1.2.x/_static/jquery-3.6.0.js:4588
Function
noop
()
docs/1.1.x/_static/underscore-1.12.0.js:774
Function
noop
()
docs/1.2.x/_static/underscore-1.13.1.js:774
Method
normalization
(self)
dscribe/descriptors/lmbtr.py:263
Method
normalization
(self)
dscribe/descriptors/mbtr.py:332
Function
o
(a,c)
docs/1.1.x/_static/js/modernizr.min.js:4
Function
object
(list, values)
docs/1.1.x/_static/underscore-1.12.0.js:1776
Function
object
(list, values)
docs/1.2.x/_static/underscore-1.13.1.js:1791
Function
oe
()
docs/2.1.x/_static/jquery.js:2
Function
oe
()
docs/0.4.x/_static/jquery.js:2
Function
oe
()
docs/1.0.x/_static/jquery.js:2
Function
oe
()
docs/0.3.x/_static/jquery.js:2
Function
oe
()
docs/1.1.x/_static/jquery.js:2
Function
oe
()
docs/1.2.x/_static/jquery.js:2
Function
oe
()
docs/2.0.x/_static/jquery.js:2
Function
on_config_inited
(app, config)
docs/src/conf.py:40
Function
pairs
(obj)
docs/1.1.x/_static/underscore-1.12.0.js:545
Function
pairs
(obj)
docs/1.2.x/_static/underscore-1.13.1.js:545
Method
periodic
(self)
dscribe/descriptors/descriptor.py:103
Function
propertyOf
(obj)
docs/1.1.x/_static/underscore-1.12.0.js:777
Function
propertyOf
(obj)
docs/1.2.x/_static/underscore-1.13.1.js:777
Function
qe
(e)
docs/2.1.x/_static/jquery.js:2
Function
qe
(e)
docs/1.2.x/_static/jquery.js:2
Function
qe
(e)
docs/2.0.x/_static/jquery.js:2
Method
r_cut
(self)
dscribe/descriptors/acsf.py:254
Function
range
(start, stop, step)
docs/1.2.x/_static/underscore-1.13.1.js:1806
Function
rbf_gto
(r, n, l)
tests/testutils.py:219
Function
rbf_polynomial
(r, n, l)
tests/testutils.py:248
Method
reciprocal_lattice
Return the reciprocal lattice. Note that this is the standard reciprocal lattice used for solid state physics with a factor of 2 *
dscribe/core/lattice.py:103
Method
reciprocal_lattice_crystallographic
Returns the *crystallographic* reciprocal lattice, i.e., no factor of 2 * pi.
dscribe/core/lattice.py:119
Function
reject
(obj, predicate, context)
docs/1.1.x/_static/underscore-1.12.0.js:1382
Function
reject
(obj, predicate, context)
docs/1.2.x/_static/underscore-1.13.1.js:1397
Function
restoreScript
( elem )
docs/0.4.x/_static/jquery-3.5.1.js:5991
Function
restoreScript
( elem )
docs/1.0.x/_static/jquery-3.5.1.js:5991
Function
restoreScript
( elem )
docs/0.3.x/_static/jquery-3.5.1.js:5991
Function
restoreScript
( elem )
docs/1.1.x/_static/jquery-3.5.1.js:5991
Function
restoreScript
( elem )
docs/1.2.x/_static/jquery-3.6.0.js:5977
Function
result
(obj, path, fallback)
docs/1.1.x/_static/underscore-1.12.0.js:935
Function
result
(obj, path, fallback)
docs/1.2.x/_static/underscore-1.13.1.js:950
Function
returnFalse
()
docs/0.4.x/_static/jquery-3.5.1.js:5101
Function
returnFalse
()
docs/1.0.x/_static/jquery-3.5.1.js:5101
Function
returnFalse
()
docs/0.3.x/_static/jquery-3.5.1.js:5101
Function
returnFalse
()
docs/1.1.x/_static/jquery-3.5.1.js:5101
Function
returnFalse
()
docs/1.2.x/_static/jquery-3.6.0.js:5102
Function
returnTrue
()
docs/0.4.x/_static/jquery-3.5.1.js:5097
Function
returnTrue
()
docs/1.0.x/_static/jquery-3.5.1.js:5097
Function
returnTrue
()
docs/0.3.x/_static/jquery-3.5.1.js:5097
Function
returnTrue
()
docs/1.1.x/_static/jquery-3.5.1.js:5097
Function
returnTrue
()
docs/1.2.x/_static/jquery-3.6.0.js:5098
Function
save_gto_coefficients
Used to precalculate the numerical SOAP coefficients for a test system. Calculating these takes a significant amount of time, so during tests
tests/testutils.py:376
Function
save_poly_coefficients
Used to precalculate the numerical SOAP coefficients for a test system. Calculating these takes a significant amount of time, so during tests
tests/testutils.py:389
Function
setFilters
()
docs/0.4.x/_static/jquery-3.5.1.js:2309
Function
setFilters
()
docs/1.0.x/_static/jquery-3.5.1.js:2309
Function
setFilters
()
docs/0.3.x/_static/jquery-3.5.1.js:2309
Function
setFilters
()
docs/1.1.x/_static/jquery-3.5.1.js:2309
Function
setFilters
()
docs/1.2.x/_static/jquery-3.6.0.js:2313
Method
set_atomic_numbers
dscribe/ext/acsf.cpp:81
Method
set_g2_params
dscribe/ext/acsf.cpp:36
Method
set_g3_params
dscribe/ext/acsf.cpp:48
Method
set_g4_params
dscribe/ext/acsf.cpp:59
Method
set_g5_params
dscribe/ext/acsf.cpp:70
Method
set_r_cut
dscribe/ext/acsf.cpp:27
Function
shuffle
(obj)
docs/1.1.x/_static/underscore-1.12.0.js:1524
Function
shuffle
(obj)
docs/1.2.x/_static/underscore-1.13.1.js:1539
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