sisl
v0.8.5
Introduction
Installation
Scripts
Tutorials
Examples
File formats
API documentation
sisl
Docs
»
Index
Edit on GitHub
Index
A
|
B
|
C
|
D
|
E
|
F
|
G
|
H
|
I
|
K
|
L
|
M
|
N
|
O
|
P
|
Q
|
R
|
S
|
T
|
U
|
V
|
W
|
X
|
Z
A
a2isc() (sisl.geometry.Geometry method)
a2o() (sisl.geometry.Geometry method)
a2p() (sisl.io.siesta.tbtncSileSiesta method)
(sisl.io.siesta.tbtrans.tbtncSileSiesta method)
(sisl.io.tbtncSileSiesta method)
a2sc() (sisl.geometry.Geometry method)
a_d (sisl.io.siesta.tbtncSileSiesta attribute)
(sisl.io.siesta.tbtrans.tbtncSileSiesta attribute)
(sisl.io.tbtncSileSiesta attribute)
a_dev (sisl.io.siesta.tbtncSileSiesta attribute)
(sisl.io.siesta.tbtrans.tbtncSileSiesta attribute)
(sisl.io.tbtncSileSiesta attribute)
add() (sisl.atom.Atoms method)
(sisl.geometry.Geometry method)
add_sile() (in module sisl.io)
(in module sisl.io.sile)
add_vacuum() (sisl.supercell.SuperCell method)
(sisl.supercell.SuperCellChild method)
ADOS() (sisl.io.siesta.tbtncSileSiesta method)
(sisl.io.siesta.tbtrans.tbtncSileSiesta method)
(sisl.io.tbtncSileSiesta method)
align() (sisl.sparse.SparseCSR method)
(sisl.sparse_geometry.SparseGeometry method)
angle (sisl.quaternion.Quaternion attribute)
angle() (in module sisl.utils.misc)
append() (sisl.atom.Atoms method)
(sisl.geometry.Geometry method)
(sisl.grid.Grid method)
(sisl.selector.Selector method)
(sisl.supercell.SuperCell method)
ArgumentParser() (sisl.geometry.Geometry method)
(sisl.grid.Grid method)
(sisl.io.ASCIISileBigDFT method)
(sisl.io.BaseSile method)
(sisl.io.CARSileVASP method)
(sisl.io.MoldenSile method)
(sisl.io.REFSileScaleUp method)
(sisl.io.XSFSile method)
(sisl.io.XVSileSiesta method)
(sisl.io.XYZSile method)
(sisl.io.bandsSileSiesta method)
(sisl.io.bigdft.ASCIISileBigDFT method)
(sisl.io.bigdft.ascii.ASCIISileBigDFT method)
(sisl.io.fdfSileSiesta method)
(sisl.io.molden.MoldenSile method)
(sisl.io.ncSileSiesta method)
(sisl.io.scaleup.REFSileScaleUp method)
(sisl.io.scaleup.ref.REFSileScaleUp method)
(sisl.io.siesta.XVSileSiesta method)
(sisl.io.siesta.bands.bandsSileSiesta method)
(sisl.io.siesta.bandsSileSiesta method)
(sisl.io.siesta.fdf.fdfSileSiesta method)
(sisl.io.siesta.fdfSileSiesta method)
(sisl.io.siesta.ncSileSiesta method)
(sisl.io.siesta.siesta.ncSileSiesta method)
(sisl.io.siesta.tbtncSileSiesta method)
(sisl.io.siesta.tbtrans.tbtncSileSiesta method)
(sisl.io.siesta.xv.XVSileSiesta method)
(sisl.io.sile.BaseSile method)
(sisl.io.tbtncSileSiesta method)
(sisl.io.vasp.CARSileVASP method)
(sisl.io.vasp.car.CARSileVASP method)
(sisl.io.wannier.seedname.winSileW90 method)
(sisl.io.wannier.winSileW90 method)
(sisl.io.winSileW90 method)
(sisl.io.xsf.XSFSile method)
(sisl.io.xyz.XYZSile method)
ArgumentParser_out() (sisl.io.BaseSile method)
(sisl.io.XSFSile method)
(sisl.io.sile.BaseSile method)
(sisl.io.xsf.XSFSile method)
argv_negative_fix() (in module sisl.utils.cmd)
asc2uc() (sisl.geometry.Geometry method)
ASCIISileBigDFT (class in sisl.io)
(class in sisl.io.bigdft)
(class in sisl.io.bigdft.ascii)
Atom (class in sisl.atom)
atom (sisl.atom.Atoms attribute)
(sisl.geometry.Geometry attribute)
atom_current() (sisl.io.siesta.tbtncSileSiesta method)
(sisl.io.siesta.tbtrans.tbtncSileSiesta method)
(sisl.io.tbtncSileSiesta method)
atom_current_from_orbital() (sisl.io.siesta.tbtncSileSiesta method)
(sisl.io.siesta.tbtrans.tbtncSileSiesta method)
(sisl.io.tbtncSileSiesta method)
atomic_mass() (sisl.atom.PeriodicTable method)
Atoms (class in sisl.atom)
atoms (sisl.geometry.Geometry attribute)
attach() (sisl.geometry.Geometry method)
average() (sisl.grid.Grid method)
axyz() (sisl.geometry.Geometry method)
B
bandsSileSiesta (class in sisl.io)
(class in sisl.io.siesta)
(class in sisl.io.siesta.bands)
BaseSile (class in sisl.io)
(class in sisl.io.sile)
bcc() (in module sisl.geom.basic)
BDOS() (sisl.io.siesta.tbtncSileSiesta method)
(sisl.io.siesta.tbtrans.tbtncSileSiesta method)
(sisl.io.tbtncSileSiesta method)
best (sisl.selector.Selector attribute)
bond_correct() (sisl.geometry.Geometry method)
bond_current() (sisl.io.siesta.tbtncSileSiesta method)
(sisl.io.siesta.tbtrans.tbtncSileSiesta method)
(sisl.io.tbtncSileSiesta method)
bond_current_from_orbital() (sisl.io.siesta.tbtncSileSiesta method)
(sisl.io.siesta.tbtrans.tbtncSileSiesta method)
(sisl.io.tbtncSileSiesta method)
BrillouinZone (class in sisl.physics.brillouinzone)
BulkDOS() (sisl.io.siesta.tbtncSileSiesta method)
(sisl.io.siesta.tbtrans.tbtncSileSiesta method)
(sisl.io.tbtncSileSiesta method)
C
CARSileVASP (class in sisl.io)
(class in sisl.io.vasp)
(class in sisl.io.vasp.car)
cell (sisl.io.siesta.tbtncSileSiesta attribute)
(sisl.io.siesta.tbtrans.tbtncSileSiesta attribute)
(sisl.io.tbtncSileSiesta attribute)
(sisl.supercell.SuperCell attribute)
(sisl.supercell.SuperCellChild attribute)
center (sisl.shape.shape.Shape attribute)
center() (sisl.geometry.Geometry method)
(sisl.supercell.SuperCell method)
chemical_potential() (sisl.io.siesta.tbtncSileSiesta method)
(sisl.io.siesta.tbtrans.tbtncSileSiesta method)
(sisl.io.tbtncSileSiesta method)
close() (sisl.geometry.Geometry method)
close_all() (sisl.geometry.Geometry method)
close_sc() (sisl.geometry.Geometry method)
collect_arguments() (in module sisl.utils.cmd)
collect_input() (in module sisl.utils.cmd)
configuration() (in module sisl.io.bigdft.setup)
(in module sisl.io.gulp.setup)
(in module sisl.io.scaleup.setup)
(in module sisl.io.siesta.setup)
(in module sisl.io.vasp.setup)
(in module sisl.io.wannier.setup)
(in module sisl.setup)
conj() (sisl.quaternion.Quaternion method)
construct() (sisl.sparse_geometry.SparseGeometry method)
CONTCARSileVASP (class in sisl.io)
(class in sisl.io.vasp)
(class in sisl.io.vasp.car)
copy() (sisl.atom.Atom method)
(sisl.atom.Atoms method)
(sisl.geometry.Geometry method)
(sisl.grid.Grid method)
(sisl.physics.spin.Spin method)
(sisl.quaternion.Quaternion method)
(sisl.sparse.SparseCSR method)
(sisl.sparse_geometry.SparseGeometry method)
(sisl.supercell.SuperCell method)
correct_Newton() (sisl.physics.hessian.Hessian method)
create_construct() (sisl.sparse_geometry.SparseGeometry method)
cross_section() (sisl.grid.Grid method)
Cube (class in sisl.shape.prism4)
CUBESile (class in sisl.io)
(class in sisl.io.cube)
Cuboid (class in sisl.shape.prism4)
current() (sisl.io.siesta.tbtncSileSiesta method)
(sisl.io.siesta.tbtrans.tbtncSileSiesta method)
(sisl.io.tbtncSileSiesta method)
cut() (sisl.geometry.Geometry method)
(sisl.sparse_geometry.SparseAtom method)
(sisl.sparse_geometry.SparseOrbital method)
(sisl.supercell.SuperCell method)
D
D (sisl.physics.densitymatrix.DensityMatrix attribute)
(sisl.physics.hessian.Hessian attribute)
data (sisl.sparse.SparseCSR attribute)
dcell (sisl.grid.Grid attribute)
dec_collect_action() (in module sisl.utils.cmd)
dec_collect_and_run_action() (in module sisl.utils.cmd)
dec_default_AP() (in module sisl.utils.cmd)
dec_run_actions() (in module sisl.utils.cmd)
default_namespace() (in module sisl.utils.cmd)
degree (sisl.quaternion.Quaternion attribute)
DensityMatrix (class in sisl.physics.densitymatrix)
dHncSileSiesta (class in sisl.io)
(class in sisl.io.siesta)
(class in sisl.io.siesta.tbtrans)
diags() (sisl.sparse.SparseCSR class method)
diamond() (in module sisl.geom.special)
dim (sisl.sparse.SparseCSR attribute)
(sisl.sparse_geometry.SparseGeometry attribute)
direction() (in module sisl.utils.misc)
Dirichlet (sisl.grid.Grid attribute)
displacement (sisl.shape.ellipsoid.Ellipsoid attribute)
(sisl.shape.prism4.Cuboid attribute)
(sisl.shape.shape.Shape attribute)
distance() (sisl.geometry.Geometry method)
Dk() (sisl.physics.densitymatrix.DensityMatrix method)
(sisl.physics.hessian.Hessian method)
dkind (sisl.physics.spin.Spin attribute)
(sisl.sparse.SparseCSR attribute)
(sisl.sparse_geometry.SparseGeometry attribute)
DOS() (sisl.io.siesta.tbtncSileSiesta method)
(sisl.io.siesta.tbtrans.tbtncSileSiesta method)
(sisl.io.tbtncSileSiesta method)
DOS_A() (sisl.io.siesta.tbtncSileSiesta method)
(sisl.io.siesta.tbtrans.tbtncSileSiesta method)
(sisl.io.tbtncSileSiesta method)
DOS_bulk() (sisl.io.siesta.tbtncSileSiesta method)
(sisl.io.siesta.tbtrans.tbtncSileSiesta method)
(sisl.io.tbtncSileSiesta method)
DOS_Gf() (sisl.io.siesta.tbtncSileSiesta method)
(sisl.io.siesta.tbtrans.tbtncSileSiesta method)
(sisl.io.tbtncSileSiesta method)
dtype (sisl.grid.Grid attribute)
(sisl.physics.spin.Spin attribute)
(sisl.sparse.SparseCSR attribute)
(sisl.sparse_geometry.SparseGeometry attribute)
dvol (sisl.grid.Grid attribute)
DynamicalMatrix (in module sisl.physics.hessian)
E
E (sisl.io.siesta.tbtncSileSiesta attribute)
(sisl.io.siesta.tbtrans.tbtncSileSiesta attribute)
(sisl.io.tbtncSileSiesta attribute)
(sisl.physics.energydensitymatrix.EnergyDensityMatrix attribute)
edge_length (sisl.shape.prism4.Cuboid attribute)
eigh() (sisl.physics.sparse_physics.SparseOrbitalBZ method)
(sisl.physics.sparse_physics.SparseOrbitalBZSpin method)
eigsh() (sisl.physics.sparse_physics.SparseOrbitalBZ method)
(sisl.physics.sparse_physics.SparseOrbitalBZSpin method)
Eindex() (sisl.io.siesta.tbtncSileSiesta method)
(sisl.io.siesta.tbtrans.tbtncSileSiesta method)
(sisl.io.tbtncSileSiesta method)
Ek() (sisl.physics.energydensitymatrix.EnergyDensityMatrix method)
Elecs (sisl.io.siesta.tbtncSileSiesta attribute)
elecs (sisl.io.siesta.tbtncSileSiesta attribute)
Elecs (sisl.io.siesta.tbtrans.tbtncSileSiesta attribute)
elecs (sisl.io.siesta.tbtrans.tbtncSileSiesta attribute)
Elecs (sisl.io.tbtncSileSiesta attribute)
elecs (sisl.io.tbtncSileSiesta attribute)
Electrodes (sisl.io.siesta.tbtncSileSiesta attribute)
electrodes (sisl.io.siesta.tbtncSileSiesta attribute)
Electrodes (sisl.io.siesta.tbtrans.tbtncSileSiesta attribute)
electrodes (sisl.io.siesta.tbtrans.tbtncSileSiesta attribute)
Electrodes (sisl.io.tbtncSileSiesta attribute)
electrodes (sisl.io.tbtncSileSiesta attribute)
electronic_temperature() (sisl.io.siesta.tbtncSileSiesta method)
(sisl.io.siesta.tbtrans.tbtncSileSiesta method)
(sisl.io.tbtncSileSiesta method)
eliminate_zeros() (sisl.sparse.SparseCSR method)
(sisl.sparse_geometry.SparseGeometry method)
Ellipsoid (class in sisl.shape.ellipsoid)
empty() (sisl.sparse.SparseCSR method)
(sisl.sparse_geometry.SparseGeometry method)
EnergyDensityMatrix (class in sisl.physics.energydensitymatrix)
enlarge() (sisl.shape.shape.Shape method)
ensure_namespace() (in module sisl.utils.cmd)
equal() (sisl.atom.Atom method)
(sisl.atom.Atoms method)
(sisl.geometry.Geometry method)
erange() (in module sisl.utils.ranges)
expand() (sisl.shape.ellipsoid.Ellipsoid method)
(sisl.shape.prism4.Cuboid method)
F
fcc() (in module sisl.geom.basic)
fdfSileSiesta (class in sisl.io)
(class in sisl.io.siesta)
(class in sisl.io.siesta.fdf)
file (sisl.io.fdfSileSiesta attribute)
(sisl.io.Sile attribute)
(sisl.io.SileBin attribute)
(sisl.io.SileCDF attribute)
(sisl.io.siesta.fdf.fdfSileSiesta attribute)
(sisl.io.siesta.fdfSileSiesta attribute)
(sisl.io.sile.Sile attribute)
(sisl.io.sile.SileBin attribute)
(sisl.io.sile.SileCDF attribute)
fileindex() (in module sisl.utils.ranges)
finalize() (sisl.sparse.SparseCSR method)
(sisl.sparse_geometry.SparseGeometry method)
finalized (sisl.sparse.SparseCSR attribute)
(sisl.sparse_geometry.SparseGeometry attribute)
fit() (sisl.supercell.SuperCell method)
fromASE() (sisl.geometry.Geometry class method)
fromsp() (sisl.physics.sparse_physics.SparseOrbitalBZ class method)
(sisl.physics.sparse_physics.SparseOrbitalBZSpin class method)
(sisl.sparse_geometry.SparseGeometry class method)
fxyz (sisl.geometry.Geometry attribute)
G
geom (sisl.io.siesta.tbtncSileSiesta attribute)
(sisl.io.siesta.tbtrans.tbtncSileSiesta attribute)
(sisl.io.tbtncSileSiesta attribute)
(sisl.sparse_geometry.SparseGeometry attribute)
Geometry (class in sisl.geometry)
geometry (sisl.sparse_geometry.SparseGeometry attribute)
get() (sisl.io.fdfSileSiesta method)
(sisl.io.siesta.fdf.fdfSileSiesta method)
(sisl.io.siesta.fdfSileSiesta method)
get_sile() (in module sisl.io)
(in module sisl.io.sile)
get_sile_class() (in module sisl.io)
(in module sisl.io.sile)
get_siles() (in module sisl.io)
(in module sisl.io.sile)
gotSileGULP (class in sisl.io)
(class in sisl.io.gulp)
(class in sisl.io.gulp.got)
graphene() (in module sisl.geom.flat)
Grid (class in sisl.grid)
gridncSileSiesta (class in sisl.io)
(class in sisl.io.siesta)
(class in sisl.io.siesta.siesta_grid)
grids() (sisl.io.ncSileSiesta method)
(sisl.io.siesta.ncSileSiesta method)
(sisl.io.siesta.siesta.ncSileSiesta method)
H
H (sisl.physics.hamiltonian.Hamiltonian attribute)
Hamiltonian (class in sisl.physics.hamiltonian)
HamiltonianSile (class in sisl.io)
(class in sisl.io.ham)
hcp() (in module sisl.geom.basic)
Hessian (class in sisl.physics.hessian)
HessianSileGULP (class in sisl.io)
(class in sisl.io.gulp)
(class in sisl.io.gulp.hessian)
Hk() (sisl.physics.hamiltonian.Hamiltonian method)
honeycomb() (in module sisl.geom.flat)
I
includes() (sisl.io.fdfSileSiesta method)
(sisl.io.siesta.fdf.fdfSileSiesta method)
(sisl.io.siesta.fdfSileSiesta method)
index() (sisl.atom.Atoms method)
(sisl.grid.Grid method)
index_c2f() (in module sisl.utils.c2f)
insert() (sisl.atom.Atoms method)
(sisl.geometry.Geometry method)
interp() (sisl.grid.Grid method)
iR() (sisl.geometry.Geometry method)
is_colinear (sisl.physics.spin.Spin attribute)
is_keys() (sisl.io.Sile static method)
(sisl.io.sile.Sile static method)
is_noncolinear (sisl.physics.spin.Spin attribute)
is_orthogonal() (sisl.supercell.SuperCell method)
(sisl.supercell.SuperCellChild method)
is_polarized (sisl.physics.spin.Spin attribute)
is_spinorbit (sisl.physics.spin.Spin attribute)
is_unpolarized (sisl.physics.spin.Spin attribute)
isDataset() (sisl.io.sile.SileCDF class method)
(sisl.io.SileCDF class method)
isDimension() (sisl.io.sile.SileCDF class method)
(sisl.io.SileCDF class method)
isGroup() (sisl.io.sile.SileCDF class method)
(sisl.io.SileCDF class method)
ispmatrix() (in module sisl.sparse)
ispmatrixd() (in module sisl.sparse)
isRoot() (sisl.io.sile.SileCDF class method)
(sisl.io.SileCDF class method)
isVariable() (sisl.io.sile.SileCDF class method)
(sisl.io.SileCDF class method)
iter() (sisl.geometry.Geometry method)
(sisl.io.SileCDF method)
(sisl.io.sile.SileCDF method)
(sisl.physics.sparse_physics.SparseOrbitalBZ method)
iter_block() (sisl.geometry.Geometry method)
iter_block_rand() (sisl.geometry.Geometry method)
iter_block_shape() (sisl.geometry.Geometry method)
iter_nnz() (sisl.sparse.SparseCSR method)
(sisl.sparse_geometry.SparseAtom method)
(sisl.sparse_geometry.SparseGeometry method)
(sisl.sparse_geometry.SparseOrbital method)
iter_orbitals() (sisl.geometry.Geometry method)
iter_shape() (in module sisl.utils.misc)
iter_species() (sisl.geometry.Geometry method)
iwithin() (sisl.shape.ellipsoid.Ellipsoid method)
(sisl.shape.prism4.Cuboid method)
(sisl.shape.shape.Shape method)
K
k() (sisl.physics.brillouinzone.BrillouinZone method)
kb() (sisl.physics.brillouinzone.BrillouinZone method)
key() (sisl.io.fdfSileSiesta method)
(sisl.io.siesta.fdf.fdfSileSiesta method)
(sisl.io.siesta.fdfSileSiesta method)
key2case() (sisl.io.Sile static method)
(sisl.io.sile.Sile static method)
keys2case() (sisl.io.Sile static method)
(sisl.io.sile.Sile static method)
kind (sisl.physics.spin.Spin attribute)
kpt (sisl.io.siesta.tbtncSileSiesta attribute)
(sisl.io.siesta.tbtrans.tbtncSileSiesta attribute)
(sisl.io.tbtncSileSiesta attribute)
kT() (sisl.io.siesta.tbtncSileSiesta method)
(sisl.io.siesta.tbtrans.tbtncSileSiesta method)
(sisl.io.tbtncSileSiesta method)
L
lasto (sisl.geometry.Geometry attribute)
(sisl.io.siesta.tbtncSileSiesta attribute)
(sisl.io.siesta.tbtrans.tbtncSileSiesta attribute)
(sisl.io.tbtncSileSiesta attribute)
line_has_key() (sisl.io.Sile static method)
(sisl.io.sile.Sile static method)
line_has_keys() (sisl.io.Sile static method)
(sisl.io.sile.Sile static method)
lineark() (sisl.physics.brillouinzone.PathBZ method)
linearticks() (sisl.physics.brillouinzone.PathBZ method)
list2range() (in module sisl.utils.ranges)
lstranges() (in module sisl.utils.ranges)
M
mass (sisl.atom.Atoms attribute)
(sisl.geometry.Geometry attribute)
maxR() (sisl.atom.Atom method)
(sisl.atom.Atoms method)
(sisl.geometry.Geometry method)
mean() (sisl.grid.Grid method)
merge_instances() (in module sisl.utils.misc)
mirror() (sisl.geometry.Geometry method)
MoldenSile (class in sisl.io)
(class in sisl.io.molden)
move() (sisl.geometry.Geometry method)
(sisl.supercell.SuperCell method)
mu() (sisl.io.siesta.tbtncSileSiesta method)
(sisl.io.siesta.tbtrans.tbtncSileSiesta method)
(sisl.io.tbtncSileSiesta method)
N
n_s (sisl.supercell.SuperCell attribute)
(sisl.supercell.SuperCellChild attribute)
na (sisl.geometry.Geometry attribute)
(sisl.io.siesta.tbtncSileSiesta attribute)
(sisl.io.siesta.tbtrans.tbtncSileSiesta attribute)
(sisl.io.tbtncSileSiesta attribute)
na_d (sisl.io.siesta.tbtncSileSiesta attribute)
(sisl.io.siesta.tbtrans.tbtncSileSiesta attribute)
(sisl.io.tbtncSileSiesta attribute)
na_dev (sisl.io.siesta.tbtncSileSiesta attribute)
(sisl.io.siesta.tbtrans.tbtncSileSiesta attribute)
(sisl.io.tbtncSileSiesta attribute)
na_s (sisl.geometry.Geometry attribute)
na_u (sisl.io.siesta.tbtncSileSiesta attribute)
(sisl.io.siesta.tbtrans.tbtncSileSiesta attribute)
(sisl.io.tbtncSileSiesta attribute)
nanotube() (in module sisl.geom.nanotube)
ncSileSiesta (class in sisl.io)
(class in sisl.io.siesta)
(class in sisl.io.siesta.siesta)
nE (sisl.io.siesta.tbtncSileSiesta attribute)
ne (sisl.io.siesta.tbtncSileSiesta attribute)
nE (sisl.io.siesta.tbtrans.tbtncSileSiesta attribute)
ne (sisl.io.siesta.tbtrans.tbtncSileSiesta attribute)
nE (sisl.io.tbtncSileSiesta attribute)
ne (sisl.io.tbtncSileSiesta attribute)
Neumann (sisl.grid.Grid attribute)
next() (sisl.selector.Selector method)
nkpt (sisl.io.siesta.tbtavncSileSiesta attribute)
(sisl.io.siesta.tbtncSileSiesta attribute)
(sisl.io.siesta.tbtrans.tbtncSileSiesta attribute)
(sisl.io.siesta.tbtrans_av.tbtavncSileSiesta attribute)
(sisl.io.tbtavncSileSiesta attribute)
(sisl.io.tbtncSileSiesta attribute)
nnz (sisl.sparse.SparseCSR attribute)
(sisl.sparse_geometry.SparseGeometry attribute)
no (sisl.atom.Atoms attribute)
(sisl.geometry.Geometry attribute)
(sisl.io.siesta.tbtncSileSiesta attribute)
(sisl.io.siesta.tbtrans.tbtncSileSiesta attribute)
(sisl.io.tbtncSileSiesta attribute)
no_d (sisl.io.siesta.tbtncSileSiesta attribute)
(sisl.io.siesta.tbtrans.tbtncSileSiesta attribute)
(sisl.io.tbtncSileSiesta attribute)
no_s (sisl.geometry.Geometry attribute)
no_u (sisl.io.siesta.tbtncSileSiesta attribute)
(sisl.io.siesta.tbtrans.tbtncSileSiesta attribute)
(sisl.io.tbtncSileSiesta attribute)
NONCOLLINEAR (sisl.physics.spin.Spin attribute)
norm() (sisl.quaternion.Quaternion method)
nsc (sisl.supercell.SuperCell attribute)
(sisl.supercell.SuperCellChild attribute)
O
o2a() (sisl.geometry.Geometry method)
o2isc() (sisl.geometry.Geometry method)
o2p() (sisl.io.siesta.tbtncSileSiesta method)
(sisl.io.siesta.tbtrans.tbtncSileSiesta method)
(sisl.io.tbtncSileSiesta method)
o2sc() (sisl.geometry.Geometry method)
offset() (sisl.supercell.SuperCell method)
optimize_nsc() (sisl.geometry.Geometry method)
orbital_current() (sisl.io.siesta.tbtncSileSiesta method)
(sisl.io.siesta.tbtrans.tbtncSileSiesta method)
(sisl.io.tbtncSileSiesta method)
orbitals (sisl.atom.Atoms attribute)
(sisl.geometry.Geometry attribute)
orboccSileScaleUp (class in sisl.io)
(class in sisl.io.scaleup)
(class in sisl.io.scaleup.orbocc)
ordered (sisl.selector.Selector attribute)
origo (sisl.shape.prism4.Cuboid attribute)
(sisl.shape.shape.Shape attribute)
orij() (sisl.geometry.Geometry method)
orthogonal (sisl.physics.sparse_physics.SparseOrbitalBZ attribute)
osc2uc() (sisl.geometry.Geometry method)
outSileSiesta (class in sisl.io)
(class in sisl.io.siesta)
(class in sisl.io.siesta.out)
P
parallel() (sisl.supercell.SuperCell method)
PathBZ (class in sisl.physics.brillouinzone)
performances (sisl.selector.Selector attribute)
Periodic (sisl.grid.Grid attribute)
PeriodicTable (class in sisl.atom)
phtavncSileSiesta (class in sisl.io)
(class in sisl.io.siesta)
(class in sisl.io.siesta.tbtrans_av)
phtncSileSiesta (class in sisl.io)
(class in sisl.io.siesta)
(class in sisl.io.siesta.tbtrans)
phtprojncSileSiesta (class in sisl.io)
(class in sisl.io.siesta)
(class in sisl.io.siesta.tbtrans_proj)
pivot (sisl.io.siesta.tbtncSileSiesta attribute)
(sisl.io.siesta.tbtrans.tbtncSileSiesta attribute)
(sisl.io.tbtncSileSiesta attribute)
POLARIZED (sisl.physics.spin.Spin attribute)
POSCARSileVASP (class in sisl.io)
(class in sisl.io.vasp)
(class in sisl.io.vasp.car)
prepend() (sisl.atom.Atoms method)
(sisl.geometry.Geometry method)
(sisl.selector.Selector method)
(sisl.supercell.SuperCell method)
print() (sisl.io.fdfSileSiesta static method)
(sisl.io.siesta.fdf.fdfSileSiesta static method)
(sisl.io.siesta.fdfSileSiesta static method)
pvt (sisl.io.siesta.tbtncSileSiesta attribute)
(sisl.io.siesta.tbtrans.tbtncSileSiesta attribute)
(sisl.io.tbtncSileSiesta attribute)
Q
Quaternion (class in sisl.quaternion)
R
radians (sisl.quaternion.Quaternion attribute)
radii() (sisl.atom.Atom method)
(sisl.atom.PeriodicTable method)
radius (sisl.shape.ellipsoid.Ellipsoid attribute)
radius() (sisl.atom.Atom method)
(sisl.atom.PeriodicTable method)
rcell (sisl.supercell.SuperCell attribute)
(sisl.supercell.SuperCellChild attribute)
read() (sisl.geometry.Geometry static method)
(sisl.grid.Grid static method)
(sisl.io.BaseSile method)
(sisl.io.sile.BaseSile method)
(sisl.physics.densitymatrix.DensityMatrix static method)
(sisl.physics.energydensitymatrix.EnergyDensityMatrix static method)
(sisl.physics.hamiltonian.Hamiltonian static method)
(sisl.physics.hessian.Hessian static method)
(sisl.supercell.SuperCell static method)
read_atom() (sisl.io.orboccSileScaleUp method)
(sisl.io.scaleup.orbocc.orboccSileScaleUp method)
(sisl.io.scaleup.orboccSileScaleUp method)
read_data() (sisl.io.bandsSileSiesta method)
(sisl.io.outSileSiesta method)
(sisl.io.siesta.bands.bandsSileSiesta method)
(sisl.io.siesta.bandsSileSiesta method)
(sisl.io.siesta.out.outSileSiesta method)
(sisl.io.siesta.outSileSiesta method)
(sisl.io.siesta.tbtncSileSiesta method)
(sisl.io.siesta.tbtrans.tbtncSileSiesta method)
(sisl.io.tbtncSileSiesta method)
read_density_matrix() (sisl.io.ncSileSiesta method)
(sisl.io.siesta.ncSileSiesta method)
(sisl.io.siesta.siesta.ncSileSiesta method)
read_energy_density_matrix() (sisl.io.ncSileSiesta method)
(sisl.io.siesta.ncSileSiesta method)
(sisl.io.siesta.siesta.ncSileSiesta method)
read_es() (sisl.io.BaseSile method)
(sisl.io.sile.BaseSile method)
read_force() (sisl.io.outSileSiesta method)
(sisl.io.siesta.out.outSileSiesta method)
(sisl.io.siesta.outSileSiesta method)
read_geom() (sisl.io.BaseSile method)
(sisl.io.sile.BaseSile method)
read_geometry() (sisl.io.ASCIISileBigDFT method)
(sisl.io.CARSileVASP method)
(sisl.io.CUBESile method)
(sisl.io.HamiltonianSile method)
(sisl.io.REFSileScaleUp method)
(sisl.io.TSHSSileSiesta method)
(sisl.io.XSFSile method)
(sisl.io.XVSileSiesta method)
(sisl.io.XYZSile method)
(sisl.io.bigdft.ASCIISileBigDFT method)
(sisl.io.bigdft.ascii.ASCIISileBigDFT method)
(sisl.io.cube.CUBESile method)
(sisl.io.fdfSileSiesta method)
(sisl.io.gotSileGULP method)
(sisl.io.gulp.got.gotSileGULP method)
(sisl.io.gulp.gotSileGULP method)
(sisl.io.ham.HamiltonianSile method)
(sisl.io.ncSileSiesta method)
(sisl.io.outSileSiesta method)
(sisl.io.restartSileScaleUp method)
(sisl.io.scaleup.REFSileScaleUp method)
(sisl.io.scaleup.ref.REFSileScaleUp method)
(sisl.io.scaleup.ref.restartSileScaleUp method)
(sisl.io.scaleup.restartSileScaleUp method)
(sisl.io.siesta.TSHSSileSiesta method)
(sisl.io.siesta.XVSileSiesta method)
(sisl.io.siesta.binaries.TSHSSileSiesta method)
(sisl.io.siesta.fdf.fdfSileSiesta method)
(sisl.io.siesta.fdfSileSiesta method)
(sisl.io.siesta.ncSileSiesta method)
(sisl.io.siesta.out.outSileSiesta method)
(sisl.io.siesta.outSileSiesta method)
(sisl.io.siesta.siesta.ncSileSiesta method)
(sisl.io.siesta.tbtncSileSiesta method)
(sisl.io.siesta.tbtrans.tbtncSileSiesta method)
(sisl.io.siesta.xv.XVSileSiesta method)
(sisl.io.tbtncSileSiesta method)
(sisl.io.vasp.CARSileVASP method)
(sisl.io.vasp.car.CARSileVASP method)
(sisl.io.wannier.seedname.winSileW90 method)
(sisl.io.wannier.winSileW90 method)
(sisl.io.winSileW90 method)
(sisl.io.xsf.XSFSile method)
(sisl.io.xyz.XYZSile method)
read_grid() (sisl.io.cube.CUBESile method)
(sisl.io.CUBESile method)
(sisl.io.gridncSileSiesta method)
(sisl.io.ncSileSiesta method)
(sisl.io.siesta.gridncSileSiesta method)
(sisl.io.siesta.ncSileSiesta method)
(sisl.io.siesta.siesta.ncSileSiesta method)
(sisl.io.siesta.siesta_grid.gridncSileSiesta method)
read_hamiltonian() (sisl.io.gotSileGULP method)
(sisl.io.HamiltonianSile method)
(sisl.io.TSHSSileSiesta method)
(sisl.io.gulp.got.gotSileGULP method)
(sisl.io.gulp.gotSileGULP method)
(sisl.io.ham.HamiltonianSile method)
(sisl.io.ncSileSiesta method)
(sisl.io.rhamSileScaleUp method)
(sisl.io.scaleup.rham.rhamSileScaleUp method)
(sisl.io.scaleup.rhamSileScaleUp method)
(sisl.io.siesta.TSHSSileSiesta method)
(sisl.io.siesta.binaries.TSHSSileSiesta method)
(sisl.io.siesta.ncSileSiesta method)
(sisl.io.siesta.siesta.ncSileSiesta method)
(sisl.io.wannier.seedname.winSileW90 method)
(sisl.io.wannier.winSileW90 method)
(sisl.io.winSileW90 method)
read_hessian() (sisl.io.gotSileGULP method)
(sisl.io.HessianSileGULP method)
(sisl.io.gulp.HessianSileGULP method)
(sisl.io.gulp.got.gotSileGULP method)
(sisl.io.gulp.gotSileGULP method)
(sisl.io.gulp.hessian.HessianSileGULP method)
(sisl.io.ncSileSiesta method)
(sisl.io.siesta.ncSileSiesta method)
(sisl.io.siesta.siesta.ncSileSiesta method)
read_moment() (sisl.io.outSileSiesta method)
(sisl.io.siesta.out.outSileSiesta method)
(sisl.io.siesta.outSileSiesta method)
read_sc() (sisl.io.BaseSile method)
(sisl.io.sile.BaseSile method)
read_species() (sisl.io.outSileSiesta method)
(sisl.io.siesta.out.outSileSiesta method)
(sisl.io.siesta.outSileSiesta method)
read_super() (sisl.io.gotSileGULP method)
(sisl.io.gulp.got.gotSileGULP method)
(sisl.io.gulp.gotSileGULP method)
read_supercell() (sisl.io.CARSileVASP method)
(sisl.io.CUBESile method)
(sisl.io.REFSileScaleUp method)
(sisl.io.TSHSSileSiesta method)
(sisl.io.XVSileSiesta method)
(sisl.io.cube.CUBESile method)
(sisl.io.fdfSileSiesta method)
(sisl.io.gotSileGULP method)
(sisl.io.gridncSileSiesta method)
(sisl.io.gulp.got.gotSileGULP method)
(sisl.io.gulp.gotSileGULP method)
(sisl.io.ncSileSiesta method)
(sisl.io.scaleup.REFSileScaleUp method)
(sisl.io.scaleup.ref.REFSileScaleUp method)
(sisl.io.siesta.TSHSSileSiesta method)
(sisl.io.siesta.XVSileSiesta method)
(sisl.io.siesta.binaries.TSHSSileSiesta method)
(sisl.io.siesta.fdf.fdfSileSiesta method)
(sisl.io.siesta.fdfSileSiesta method)
(sisl.io.siesta.gridncSileSiesta method)
(sisl.io.siesta.ncSileSiesta method)
(sisl.io.siesta.siesta.ncSileSiesta method)
(sisl.io.siesta.siesta_grid.gridncSileSiesta method)
(sisl.io.siesta.tbtncSileSiesta method)
(sisl.io.siesta.tbtrans.tbtncSileSiesta method)
(sisl.io.siesta.xv.XVSileSiesta method)
(sisl.io.tbtncSileSiesta method)
(sisl.io.vasp.CARSileVASP method)
(sisl.io.vasp.car.CARSileVASP method)
(sisl.io.wannier.seedname.winSileW90 method)
(sisl.io.wannier.winSileW90 method)
(sisl.io.winSileW90 method)
readline() (sisl.io.fdfSileSiesta method)
(sisl.io.Sile method)
(sisl.io.siesta.fdf.fdfSileSiesta method)
(sisl.io.siesta.fdfSileSiesta method)
(sisl.io.sile.Sile method)
reduce() (sisl.atom.Atoms method)
REFSileScaleUp (class in sisl.io)
(class in sisl.io.scaleup)
(class in sisl.io.scaleup.ref)
register_math() (sisl.sparse.SparseCSR class method)
remove() (sisl.atom.Atoms method)
(sisl.geometry.Geometry method)
(sisl.grid.Grid method)
(sisl.sparse_geometry.SparseAtom method)
remove_part() (sisl.grid.Grid method)
reorder() (sisl.atom.Atoms method)
repeat() (sisl.atom.Atoms method)
(sisl.geometry.Geometry method)
(sisl.sparse_geometry.SparseAtom method)
(sisl.sparse_geometry.SparseOrbital method)
reset() (sisl.selector.Selector method)
(sisl.sparse_geometry.SparseGeometry method)
restartSileScaleUp (class in sisl.io)
(class in sisl.io.scaleup)
(class in sisl.io.scaleup.ref)
reverse() (sisl.atom.Atoms method)
(sisl.geometry.Geometry method)
rhamSileScaleUp (class in sisl.io)
(class in sisl.io.scaleup)
(class in sisl.io.scaleup.rham)
rij() (sisl.geometry.Geometry method)
rotate() (sisl.geometry.Geometry method)
(sisl.quaternion.Quaternion method)
(sisl.supercell.SuperCell method)
rotate_miller() (sisl.geometry.Geometry method)
rotatea() (sisl.geometry.Geometry method)
(sisl.supercell.SuperCell method)
rotateb() (sisl.geometry.Geometry method)
(sisl.supercell.SuperCell method)
rotatec() (sisl.geometry.Geometry method)
(sisl.supercell.SuperCell method)
routines (sisl.selector.Selector attribute)
S
S (sisl.physics.sparse_physics.SparseOrbitalBZ attribute)
sc() (in module sisl.geom.basic)
sc2uc() (sisl.geometry.Geometry method)
sc_index() (sisl.supercell.SuperCell method)
(sisl.supercell.SuperCellChild method)
sc_off (sisl.supercell.SuperCell attribute)
(sisl.supercell.SuperCellChild attribute)
scale() (sisl.atom.Atom method)
(sisl.atom.Atoms method)
(sisl.geometry.Geometry method)
(sisl.supercell.SuperCell method)
sdata() (in module sisl.utils.sdata)
select_best() (sisl.selector.Selector method)
Selector (class in sisl.selector)
SelfEnergy (class in sisl.physics.self_energy)
SemiInfinite (class in sisl.physics.self_energy)
set() (sisl.io.fdfSileSiesta method)
(sisl.io.siesta.fdf.fdfSileSiesta method)
(sisl.io.siesta.fdfSileSiesta method)
set_bc() (sisl.grid.Grid method)
set_boundary() (sisl.grid.Grid method)
set_boundary_condition() (sisl.grid.Grid method)
set_center() (sisl.shape.ellipsoid.Ellipsoid method)
(sisl.shape.ellipsoid.Sphere method)
(sisl.shape.ellipsoid.Spheroid method)
(sisl.shape.prism4.Cuboid method)
set_dyn_key() (sisl.io.gotSileGULP method)
(sisl.io.gulp.got.gotSileGULP method)
(sisl.io.gulp.gotSileGULP method)
set_geom() (sisl.grid.Grid method)
set_geometry_key() (sisl.io.gotSileGULP method)
(sisl.io.gulp.got.gotSileGULP method)
(sisl.io.gulp.gotSileGULP method)
set_grid() (sisl.grid.Grid method)
set_hessian_key() (sisl.io.gotSileGULP method)
(sisl.io.gulp.got.gotSileGULP method)
(sisl.io.gulp.gotSileGULP method)
set_key() (sisl.io.gotSileGULP method)
(sisl.io.gulp.got.gotSileGULP method)
(sisl.io.gulp.gotSileGULP method)
set_nsc() (sisl.supercell.SuperCell method)
(sisl.supercell.SuperCellChild method)
set_origo() (sisl.shape.prism4.Cuboid method)
set_sc() (sisl.supercell.SuperCellChild method)
set_supercell() (sisl.supercell.SuperCell method)
(sisl.supercell.SuperCellChild method)
set_supercell_key() (sisl.io.gotSileGULP method)
(sisl.io.gulp.got.gotSileGULP method)
(sisl.io.gulp.gotSileGULP method)
sgeom() (in module sisl.geometry)
sgrid() (in module sisl.grid)
Shape (class in sisl.shape.shape)
shape (sisl.grid.Grid attribute)
(sisl.sparse.SparseCSR attribute)
(sisl.sparse_geometry.SparseGeometry attribute)
shift() (sisl.physics.hamiltonian.Hamiltonian method)
Sile (class in sisl.io)
(class in sisl.io.sile)
Sile_fh_open() (in module sisl.io)
(in module sisl.io.sile)
sile_raise_read() (in module sisl.io)
(in module sisl.io.sile)
sile_raise_write() (in module sisl.io)
(in module sisl.io.sile)
SileBigDFT (class in sisl.io)
(class in sisl.io.bigdft)
(class in sisl.io.bigdft.sile)
SileBin (class in sisl.io)
(class in sisl.io.sile)
SileBinBigDFT (class in sisl.io)
(class in sisl.io.bigdft)
(class in sisl.io.bigdft.sile)
SileBinScaleUp (class in sisl.io)
(class in sisl.io.scaleup)
(class in sisl.io.scaleup.sile)
SileBinSIESTA (class in sisl.io)
(class in sisl.io.siesta)
(class in sisl.io.siesta.sile)
SileBinVASP (class in sisl.io)
(class in sisl.io.vasp)
(class in sisl.io.vasp.sile)
SileCDF (class in sisl.io)
(class in sisl.io.sile)
SileCDFBigDFT (class in sisl.io)
(class in sisl.io.bigdft)
(class in sisl.io.bigdft.sile)
SileCDFGULP (class in sisl.io)
(class in sisl.io.gulp)
(class in sisl.io.gulp.sile)
SileCDFScaleUp (class in sisl.io)
(class in sisl.io.scaleup)
(class in sisl.io.scaleup.sile)
SileCDFSIESTA (class in sisl.io)
(class in sisl.io.siesta)
(class in sisl.io.siesta.sile)
SileCDFVASP (class in sisl.io)
(class in sisl.io.vasp)
(class in sisl.io.vasp.sile)
SileError
,
[1]
SileGULP (class in sisl.io)
(class in sisl.io.gulp)
(class in sisl.io.gulp.sile)
SileScaleUp (class in sisl.io)
(class in sisl.io.scaleup)
(class in sisl.io.scaleup.sile)
SileSiesta (class in sisl.io)
(class in sisl.io.siesta)
(class in sisl.io.siesta.sile)
SileVASP (class in sisl.io)
(class in sisl.io.vasp)
(class in sisl.io.vasp.sile)
SileW90 (class in sisl.io)
(class in sisl.io.wannier)
(class in sisl.io.wannier.sile)
sisl (module)
sisl.atom (module)
sisl.geom (module)
sisl.geom.basic (module)
sisl.geom.flat (module)
sisl.geom.nanotube (module)
sisl.geom.special (module)
sisl.geometry (module)
sisl.grid (module)
sisl.info (module)
sisl.io (module)
sisl.io.bigdft (module)
sisl.io.bigdft.ascii (module)
sisl.io.bigdft.setup (module)
sisl.io.bigdft.sile (module)
sisl.io.cube (module)
sisl.io.gulp (module)
sisl.io.gulp.got (module)
sisl.io.gulp.hessian (module)
sisl.io.gulp.setup (module)
sisl.io.gulp.sile (module)
sisl.io.ham (module)
sisl.io.molden (module)
sisl.io.scaleup (module)
sisl.io.scaleup.orbocc (module)
sisl.io.scaleup.ref (module)
sisl.io.scaleup.rham (module)
sisl.io.scaleup.setup (module)
sisl.io.scaleup.sile (module)
sisl.io.siesta (module)
sisl.io.siesta.bands (module)
sisl.io.siesta.binaries (module)
sisl.io.siesta.fdf (module)
sisl.io.siesta.out (module)
sisl.io.siesta.setup (module)
sisl.io.siesta.siesta (module)
sisl.io.siesta.siesta_grid (module)
sisl.io.siesta.sile (module)
sisl.io.siesta.tbtrans (module)
sisl.io.siesta.tbtrans_av (module)
sisl.io.siesta.tbtrans_proj (module)
sisl.io.siesta.xv (module)
sisl.io.sile (module)
sisl.io.table (module)
sisl.io.vasp (module)
sisl.io.vasp.car (module)
sisl.io.vasp.setup (module)
sisl.io.vasp.sile (module)
sisl.io.wannier (module)
sisl.io.wannier.seedname (module)
sisl.io.wannier.setup (module)
sisl.io.wannier.sile (module)
sisl.io.xsf (module)
sisl.io.xyz (module)
sisl.physics (module)
sisl.physics.brillouinzone (module)
sisl.physics.densitymatrix (module)
sisl.physics.energydensitymatrix (module)
sisl.physics.hamiltonian (module)
sisl.physics.hessian (module)
sisl.physics.self_energy (module)
sisl.physics.sparse_physics (module)
sisl.physics.spin (module)
sisl.quaternion (module)
sisl.selector (module)
sisl.setup (module)
sisl.shape (module)
sisl.shape.ellipsoid (module)
sisl.shape.prism4 (module)
sisl.shape.shape (module)
sisl.sparse (module)
sisl.sparse_geometry (module)
sisl.supercell (module)
sisl.units (module)
sisl.units.siesta (module)
sisl.utils (module)
sisl.utils.c2f (module)
sisl.utils.cmd (module)
sisl.utils.misc (module)
sisl.utils.ranges (module)
sisl.utils.sdata (module)
size (sisl.grid.Grid attribute)
Sk() (sisl.physics.sparse_physics.SparseOrbitalBZ method)
SparseAtom (class in sisl.sparse_geometry)
SparseCSR (class in sisl.sparse)
SparseGeometry (class in sisl.sparse_geometry)
SparseOrbital (class in sisl.sparse_geometry)
SparseOrbitalBZ (class in sisl.physics.sparse_physics)
SparseOrbitalBZSpin (class in sisl.physics.sparse_physics)
sparserij() (sisl.geometry.Geometry method)
specie (sisl.atom.Atoms attribute)
Sphere (class in sisl.shape.ellipsoid)
Spheroid (class in sisl.shape.ellipsoid)
Spin (class in sisl.physics.spin)
spin (sisl.physics.sparse_physics.SparseOrbitalBZSpin attribute)
(sisl.physics.spin.Spin attribute)
SPINORBIT (sisl.physics.spin.Spin attribute)
spsame() (sisl.sparse.SparseCSR method)
(sisl.sparse_geometry.SparseGeometry method)
start() (sisl.selector.Selector method)
(sisl.selector.TimeSelector method)
step_either() (sisl.io.Sile method)
(sisl.io.sile.Sile method)
step_to() (sisl.io.Sile method)
(sisl.io.sile.Sile method)
stop() (sisl.selector.Selector method)
(sisl.selector.TimeSelector method)
str_spec() (in module sisl.utils.misc)
strmap() (in module sisl.utils.ranges)
strseq() (in module sisl.utils.ranges)
sub() (sisl.atom.Atoms method)
(sisl.geometry.Geometry method)
(sisl.grid.Grid method)
(sisl.sparse_geometry.SparseAtom method)
(sisl.sparse_geometry.SparseOrbital method)
sub_part() (sisl.grid.Grid method)
sum() (sisl.grid.Grid method)
SuperCell (class in sisl.supercell)
SuperCellChild (class in sisl.supercell)
swap() (sisl.atom.Atoms method)
(sisl.geometry.Geometry method)
swapaxes() (sisl.geometry.Geometry method)
(sisl.grid.Grid method)
(sisl.supercell.SuperCell method)
symbol (sisl.atom.Atom attribute)
T
T() (sisl.io.siesta.tbtncSileSiesta method)
(sisl.io.siesta.tbtrans.tbtncSileSiesta method)
(sisl.io.tbtncSileSiesta method)
TableSile (class in sisl.io)
(class in sisl.io.table)
tbtavncSileSiesta (class in sisl.io)
(class in sisl.io.siesta)
(class in sisl.io.siesta.tbtrans_av)
tbtncSileSiesta (class in sisl.io)
(class in sisl.io.siesta)
(class in sisl.io.siesta.tbtrans)
tbtprojncSileSiesta (class in sisl.io)
(class in sisl.io.siesta)
(class in sisl.io.siesta.tbtrans_proj)
Tbulk() (sisl.io.siesta.tbtncSileSiesta method)
(sisl.io.siesta.tbtrans.tbtncSileSiesta method)
(sisl.io.tbtncSileSiesta method)
Teig() (sisl.io.siesta.tbtncSileSiesta method)
(sisl.io.siesta.tbtrans.tbtncSileSiesta method)
(sisl.io.tbtncSileSiesta method)
TightBinding (in module sisl.physics.hamiltonian)
tile() (sisl.atom.Atoms method)
(sisl.geometry.Geometry method)
(sisl.sparse_geometry.SparseAtom method)
(sisl.sparse_geometry.SparseOrbital method)
TimeSelector (class in sisl.selector)
toASE() (sisl.geometry.Geometry method)
tocell() (sisl.supercell.SuperCell class method)
tocsr() (sisl.sparse.SparseCSR method)
(sisl.sparse_geometry.SparseGeometry method)
translate() (sisl.geometry.Geometry method)
(sisl.supercell.SuperCell method)
transmission() (sisl.io.siesta.tbtncSileSiesta method)
(sisl.io.siesta.tbtrans.tbtncSileSiesta method)
(sisl.io.tbtncSileSiesta method)
transmission_bulk() (sisl.io.siesta.tbtncSileSiesta method)
(sisl.io.siesta.tbtrans.tbtncSileSiesta method)
(sisl.io.tbtncSileSiesta method)
transmission_eig() (sisl.io.siesta.tbtncSileSiesta method)
(sisl.io.siesta.tbtrans.tbtncSileSiesta method)
(sisl.io.tbtncSileSiesta method)
TSHSSileSiesta (class in sisl.io)
(class in sisl.io.siesta)
(class in sisl.io.siesta.binaries)
type() (sisl.io.fdfSileSiesta method)
(sisl.io.siesta.fdf.fdfSileSiesta method)
(sisl.io.siesta.fdfSileSiesta method)
U
unit_convert() (in module sisl.units)
(in module sisl.units.siesta)
unit_default() (in module sisl.units)
(in module sisl.units.siesta)
unit_group() (in module sisl.units)
(in module sisl.units.siesta)
UNPOLARIZED (sisl.physics.spin.Spin attribute)
V
vector_current() (sisl.io.siesta.tbtncSileSiesta method)
(sisl.io.siesta.tbtrans.tbtncSileSiesta method)
(sisl.io.tbtncSileSiesta method)
vector_current_from_orbital() (sisl.io.siesta.tbtncSileSiesta method)
(sisl.io.siesta.tbtrans.tbtncSileSiesta method)
(sisl.io.tbtncSileSiesta method)
vol (sisl.supercell.SuperCell attribute)
(sisl.supercell.SuperCellChild attribute)
volume (sisl.shape.ellipsoid.Ellipsoid attribute)
(sisl.shape.prism4.Cuboid attribute)
(sisl.shape.shape.Shape attribute)
W
winSileW90 (class in sisl.io)
(class in sisl.io.wannier)
(class in sisl.io.wannier.seedname)
within() (sisl.geometry.Geometry method)
(sisl.shape.ellipsoid.Ellipsoid method)
(sisl.shape.prism4.Cuboid method)
(sisl.shape.shape.Shape method)
within_sc() (sisl.geometry.Geometry method)
wkpt (sisl.io.siesta.tbtncSileSiesta attribute)
(sisl.io.siesta.tbtrans.tbtncSileSiesta attribute)
(sisl.io.tbtncSileSiesta attribute)
write() (sisl.geometry.Geometry method)
(sisl.grid.Grid method)
(sisl.io.BaseSile method)
(sisl.io.sile.BaseSile method)
(sisl.physics.densitymatrix.DensityMatrix method)
(sisl.physics.energydensitymatrix.EnergyDensityMatrix method)
(sisl.physics.hamiltonian.Hamiltonian method)
(sisl.physics.hessian.Hessian method)
write_data() (sisl.io.table.TableSile method)
(sisl.io.TableSile method)
write_es() (sisl.io.BaseSile method)
(sisl.io.sile.BaseSile method)
write_geom() (sisl.io.BaseSile method)
(sisl.io.sile.BaseSile method)
write_geometry() (sisl.io.ASCIISileBigDFT method)
(sisl.io.CARSileVASP method)
(sisl.io.CUBESile method)
(sisl.io.HamiltonianSile method)
(sisl.io.MoldenSile method)
(sisl.io.REFSileScaleUp method)
(sisl.io.XSFSile method)
(sisl.io.XVSileSiesta method)
(sisl.io.XYZSile method)
(sisl.io.bigdft.ASCIISileBigDFT method)
(sisl.io.bigdft.ascii.ASCIISileBigDFT method)
(sisl.io.cube.CUBESile method)
(sisl.io.dHncSileSiesta method)
(sisl.io.fdfSileSiesta method)
(sisl.io.ham.HamiltonianSile method)
(sisl.io.molden.MoldenSile method)
(sisl.io.ncSileSiesta method)
(sisl.io.scaleup.REFSileScaleUp method)
(sisl.io.scaleup.ref.REFSileScaleUp method)
(sisl.io.siesta.XVSileSiesta method)
(sisl.io.siesta.dHncSileSiesta method)
(sisl.io.siesta.fdf.fdfSileSiesta method)
(sisl.io.siesta.fdfSileSiesta method)
(sisl.io.siesta.ncSileSiesta method)
(sisl.io.siesta.siesta.ncSileSiesta method)
(sisl.io.siesta.tbtncSileSiesta method)
(sisl.io.siesta.tbtrans.dHncSileSiesta method)
(sisl.io.siesta.tbtrans.tbtncSileSiesta method)
(sisl.io.siesta.xv.XVSileSiesta method)
(sisl.io.tbtncSileSiesta method)
(sisl.io.vasp.CARSileVASP method)
(sisl.io.vasp.car.CARSileVASP method)
(sisl.io.xsf.XSFSile method)
(sisl.io.xyz.XYZSile method)
write_grid() (sisl.io.cube.CUBESile method)
(sisl.io.CUBESile method)
write_hamiltonian() (sisl.io.dHncSileSiesta method)
(sisl.io.HamiltonianSile method)
(sisl.io.ham.HamiltonianSile method)
(sisl.io.ncSileSiesta method)
(sisl.io.siesta.dHncSileSiesta method)
(sisl.io.siesta.ncSileSiesta method)
(sisl.io.siesta.siesta.ncSileSiesta method)
(sisl.io.siesta.tbtrans.dHncSileSiesta method)
write_hessian() (sisl.io.ncSileSiesta method)
(sisl.io.siesta.ncSileSiesta method)
(sisl.io.siesta.siesta.ncSileSiesta method)
write_sc() (sisl.io.BaseSile method)
(sisl.io.MoldenSile method)
(sisl.io.molden.MoldenSile method)
(sisl.io.sile.BaseSile method)
write_tbtav() (sisl.io.siesta.tbtavncSileSiesta method)
(sisl.io.siesta.tbtncSileSiesta method)
(sisl.io.siesta.tbtrans.tbtncSileSiesta method)
(sisl.io.siesta.tbtrans_av.tbtavncSileSiesta method)
(sisl.io.tbtavncSileSiesta method)
(sisl.io.tbtncSileSiesta method)
X
xa (sisl.io.siesta.tbtncSileSiesta attribute)
(sisl.io.siesta.tbtrans.tbtncSileSiesta attribute)
(sisl.io.tbtncSileSiesta attribute)
XSFSile (class in sisl.io)
(class in sisl.io.xsf)
XVSileSiesta (class in sisl.io)
(class in sisl.io.siesta)
(class in sisl.io.siesta.xv)
xyz (sisl.io.siesta.tbtncSileSiesta attribute)
(sisl.io.siesta.tbtrans.tbtncSileSiesta attribute)
(sisl.io.tbtncSileSiesta attribute)
XYZSile (class in sisl.io)
(class in sisl.io.xyz)
Z
Z() (sisl.atom.PeriodicTable method)
Z_int() (sisl.atom.PeriodicTable method)
Z_label() (sisl.atom.PeriodicTable method)
Z_short() (sisl.atom.PeriodicTable method)
Read the Docs
v: v0.8.5
Versions
latest
stable
v0.8.5
v0.8.4
v0.8.3
v0.8.2
Downloads
On Read the Docs
Project Home
Builds
Free document hosting provided by
Read the Docs
.