Index

Symbols

1131199299 (fortran variable in module random) 16163801 (fortran variable in module random) 287291 (fortran variable in module random) 299977 (fortran variable in module random) 301237 (fortran variable in module random)

362436069 (fortran variable in module random) 388673 (fortran variable in module random) 456623 (fortran variable in module random) 499819 (fortran variable in module random) 501173 (fortran variable in module random)

A

a (fortran variable in module kuboarrays) abn (fortran variable in module cell) ag (fortran variable in module cell) ampb (fortran variable in module interface) ampeh (fortran variable in module interface) ampn (fortran variable in module interface) area (fortran variable in module cell) atoms (module) atomsconstruct() (fortran subroutine in module atoms) atomsconstructasymm() (fortran subroutine in module atoms)

atomsconstructbasedonfastnn() (fortran subroutine in module atoms) atomsorder() (fortran subroutine in module atoms) atomspart() (fortran subroutine in module atoms) atomspos() (fortran subroutine in module atoms) atomsribbons() (fortran subroutine in module atoms) atomsrotate() (fortran subroutine in module atoms) atomssetcart() (fortran subroutine in module atoms) atomssetcarttemp() (fortran subroutine in module atoms) atomssetfrac() (fortran subroutine in module atoms) atomssetfractemp() (fortran subroutine in module atoms) atomssort() (fortran subroutine in module atoms)

B

b (fortran variable in module kuboarrays)

bmag (fortran variable in module magf)

C

c (fortran variable in module kuboarrays) calc (module) calcdiag() (fortran subroutine in module calc) calckubo() (fortran subroutine in module calc) calcselect() (fortran subroutine in module calc) calctunn() (fortran subroutine in module calc) cell (module) cellget() (fortran subroutine in module cell)

charge (fortran variable in module scf) cmplx_0 (fortran variable in module constants) cmplx_1 (fortran variable in module constants) cmplx_i (fortran variable in module constants) constants (module) convolve() (fortran function in module diag) cosine_transform_data() (fortran subroutine in module ham) cosine_transform_inverse() (fortran subroutine in module ham) cross() (fortran function in module ham)

D

dampeh (fortran variable in module interface) dcc (fortran variable in module ham) default_seed (fortran variable in module random) diag (module) diag3dbands() (fortran subroutine in module diag) diagbands() (fortran subroutine in module diag) diagbandsaroundk() (fortran subroutine in module diag) diagbandsg() (fortran subroutine in module diag) diagbandsrashba() (fortran subroutine in module diag) diagdos() (fortran subroutine in module diag) diagham() (fortran subroutine in module diag) diaghamarpack() (fortran subroutine in module diag) diaghampdos() (fortran subroutine in module diag) diaghamrashba() (fortran subroutine in module diag) diaghamwf() (fortran subroutine in module diag) diaginit() (fortran subroutine in module diag) diago() (fortran subroutine in module ham) diago2() (fortran subroutine in module ham) diagoconj() (fortran subroutine in module ham) diagogbn() (fortran subroutine in module ham)

diagoh0fromaabb() (fortran subroutine in module ham) diagohzfromaabb() (fortran subroutine in module ham) diagotbg() (fortran subroutine in module ham) diagpdos() (fortran subroutine in module diag) diagspectralfunction() (fortran subroutine in module diag) diagspectralfunctionkgrid() (fortran subroutine in module diag) diagspectralfunctionkgridinequivalent() (fortran subroutine in module diag) diagspectralfunctionkgridinequivalentenergycut() (fortran subroutine in module diag) diagspectralfunctionkgridinequivalentenergycutnickdale() (fortran subroutine in module diag) diagspectralweightnishi() (fortran subroutine in module diag) diagspectralweightweiku() (fortran subroutine in module diag) diagspectralweightweikuinequivalent() (fortran subroutine in module diag) diagspectralweightweikuinequivalentlee() (fortran subroutine in module diag) diagspectralweightweikuinequivalentnishi() (fortran subroutine in module diag) diagspectralweightweikuinequivalentold() (fortran subroutine in module diag) dintlay (fortran variable in module atoms) displacements (fortran variable in module atoms) distancedependentc() (fortran subroutine in module ham) dwork (fortran variable in module diag) (fortran variable in module scf)

E

e0_b (fortran variable in module tbpar) e0_c (fortran variable in module tbpar) e0_c1 (fortran variable in module tbpar) e0_c2 (fortran variable in module tbpar) e0_n (fortran variable in module tbpar)

edgeh (fortran variable in module interface) edgehopp (fortran variable in module interface) edgeindx (fortran variable in module interface) efermi (fortran variable in module diag) emax (fortran variable in module diag) emin (fortran variable in module diag)

F

fastnn() (fortran subroutine in module neigh) fastnnnotsquare() (fortran subroutine in module neigh) fastnnnotsquarebulk() (fortran subroutine in module neigh) fastnnnotsquarebulksmall() (fortran subroutine in module neigh)

fastnnnotsquarenotrectangle() (fortran subroutine in module neigh) fastnnnotsquaresmall() (fortran subroutine in module neigh) fitfunsrivani() (fortran subroutine in module ham) fluxq (fortran variable in module constants) frac (fortran variable in module atoms)

G

g0 (fortran variable in module tbpar) gauss (module) gaussheight() (fortran subroutine in module gauss) gausspot() (fortran subroutine in module gauss) gausspotdefinedpositions() (fortran subroutine in module gauss)

gcd() (fortran function in module atoms) gintlay (fortran variable in module tbpar) gn (fortran variable in module tbpar) gpzeeman (fortran variable in module ham) grabnes (fortran program) gzeeman (fortran variable in module ham)

H

h (fortran variable in module kuboarrays) h0 (fortran variable in module ham) h0bottom (fortran variable in module ham) h0top (fortran variable in module ham) habimag (fortran variable in module ham) habreal (fortran variable in module ham) haldanephase (fortran variable in module magf) haldphase (fortran variable in module magf) haldphaseinit() (fortran subroutine in module magf) haldphasevalue() (fortran subroutine in module magf) ham (module)

hamhopping() (fortran subroutine in module ham) haminit() (fortran subroutine in module ham) hamonsite() (fortran subroutine in module ham) harmonicapprox() (fortran subroutine in module ham) hbar (fortran variable in module constants) ho (fortran variable in module ham) hopp (fortran variable in module ham) hplanck (fortran variable in module constants) hstr (fortran variable in module ham) hybrid (module) hybridgen() (fortran subroutine in module hybrid)

I

in1 (fortran variable in module atoms) in2 (fortran variable in module atoms) indexofbigbubblecenter (fortran variable in module ham) indxdiv (fortran variable in module atoms) indxnode (fortran variable in module atoms) inode1 (fortran variable in module atoms) inode2 (fortran variable in module atoms)

interface (module) interfacepot1() (fortran subroutine in module interface) interfacepot2() (fortran subroutine in module interface) interlayerbl() (fortran subroutine in module ham) interlayerblaa() (fortran subroutine in module ham) interlayerblab() (fortran subroutine in module ham) interlayerblba() (fortran subroutine in module ham) interlayerdistances (fortran variable in module atoms)

K

kubo (module) kuboarrays (module) kubocn() (fortran subroutine in module kubosubs) kubodos() (fortran subroutine in module kubo) kuboevol() (fortran subroutine in module kubosubs) kubofermi() (fortran subroutine in module kubosubs) kubofrac() (fortran subroutine in module kubosubs) kuboinitwf() (fortran subroutine in module kubo)

kuboinitwflayerdos() (fortran subroutine in module kubo) kuboinitwfpdos() (fortran subroutine in module kubo) kubointerval() (fortran subroutine in module kubosubs) kuborecursion() (fortran subroutine in module kubosubs) kubosubs (module) kubotevol() (fortran subroutine in module kubo) kuboupdate_d() (fortran subroutine in module kubosubs) kuboupdate_z() (fortran subroutine in module kubosubs)

L

lambda (fortran variable in module interface) layerindex (fortran variable in module atoms)

lwork (fortran variable in module diag) (fortran variable in module scf)

M

magf (module) magfield (fortran variable in module magf) magfinit() (fortran subroutine in module magf) magfvalue() (fortran subroutine in module magf) matinv3() (fortran function in module diag) maxedgeneigh (fortran variable in module interface) maxneigh (fortran variable in module neigh)

mbf (fortran variable in module magf) mbi (fortran variable in module magf) moirestrain (fortran variable in module ham) mphif (fortran variable in module magf) mphii (fortran variable in module magf) mphistep (fortran variable in module magf) mstep (fortran variable in module magf)

N

name (module) nat (fortran variable in module atoms) natbn (fortran variable in module atoms) natc (fortran variable in module atoms) natc1 (fortran variable in module atoms) natc2 (fortran variable in module atoms) natc3 (fortran variable in module atoms) ncellint (fortran variable in module interface) ndiv (fortran variable in module parallel) nedgecell (fortran variable in module interface) nedgen (fortran variable in module interface) nei (fortran variable in module interface) neigh (module) neighcell (fortran variable in module neigh)

neighd (fortran variable in module neigh) neighindxcell() (fortran subroutine in module neigh) neighlist() (fortran subroutine in module neigh) neighlistold() (fortran subroutine in module neigh) nel (fortran variable in module atoms) nlist (fortran variable in module neigh) nlist2 (fortran variable in module neigh) nneigh (fortran variable in module neigh) nodesndrcv (fortran variable in module neigh) nq (fortran variable in module interface) nradii (fortran variable in module neigh) ns (fortran variable in module random) nspin (fortran variable in module ham) nth (fortran variable in module parallel)

O

offdiago() (fortran subroutine in module ham) offdiago2() (fortran subroutine in module ham)

offdiagogbn() (fortran subroutine in module ham) offdiagotbg() (fortran subroutine in module ham)

P

parallel (module) paralleldiv() (fortran subroutine in module parallel) phiforeffectivemodel (fortran variable in module atoms) pi (fortran variable in module constants) prefix (fortran variable in module name) prime (fortran variable in module random)

procat (fortran variable in module atoms) procid (fortran variable in module parallel) psi (fortran variable in module kuboarrays) psin (fortran variable in module kuboarrays) psinm1 (fortran variable in module kuboarrays) pzterm (fortran variable in module ham)

Q

qe (fortran variable in module constants)

R

r8vec_uniform_01() (fortran subroutine in module ham) rand_t (fortran variable in module random) randnum() (fortran function in module random) random (module) randominrange() (fortran subroutine in module ham) randomstrain (fortran variable in module ham) randseed() (fortran subroutine in module random) randtest() (fortran subroutine in module random) rat (fortran variable in module atoms) ratbn (fortran variable in module atoms)

ratc (fortran variable in module atoms) ratc1 (fortran variable in module atoms) ratc2 (fortran variable in module atoms) ratc3 (fortran variable in module atoms) ratinit (fortran variable in module atoms) rattemp (fortran variable in module atoms) rcell (fortran variable in module cell) rcvindx (fortran variable in module neigh) rcvlist (fortran variable in module neigh) rcvsz (fortran variable in module neigh) rmaxint (fortran variable in module interface)

S

scell (fortran variable in module cell) scell2 (fortran variable in module cell) scf (module) scfgetcharge() (fortran subroutine in module scf) scfham() (fortran subroutine in module scf) scfham0() (fortran subroutine in module scf) scfinit() (fortran subroutine in module scf) secat (fortran variable in module atoms)

sndindx (fortran variable in module neigh) sndlist (fortran variable in module neigh) sndsz (fortran variable in module neigh) species (fortran variable in module atoms) speciestemp (fortran variable in module atoms) spin (fortran variable in module ham) strfactor (fortran variable in module ham) sysname (fortran variable in module name)

T

tbinit() (fortran subroutine in module tbpar) tbnn (fortran variable in module tbpar) tbpar (module) tempd (fortran variable in module kuboarrays)

tempz (fortran variable in module kuboarrays) timestamp() (fortran subroutine in module ham) tql2() (fortran subroutine in module kubosubs) twopi (fortran variable in module constants)

U

u (fortran variable in module tbpar) ub (fortran variable in module constants)

ucell (fortran variable in module cell) unknown_type (fortran type in module random) update (fortran variable in module version)

V

ver (fortran variable in module version) version (module)

versionget() (fortran function in module version) versionupdate() (fortran function in module version) volume (fortran variable in module cell)

X

xdiv (fortran variable in module parallel) xpnpsi (fortran variable in module kuboarrays)

xpnpsim1 (fortran variable in module kuboarrays) xsubdiv (fortran variable in module parallel)

Y

ydiv (fortran variable in module parallel)

ysubdiv (fortran variable in module parallel)

Z

zch (fortran variable in module scf) zterm (fortran variable in module ham)

zupsi (fortran variable in module kuboarrays) zwork (fortran variable in module diag) (fortran variable in module scf)