atomes 1.2.1
atomes: an atomic scale modeling tool box
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Data Types | Variables
parameters Module Reference

Data Types

type  at
 
type  lattice
 
type  mol
 
type  pixel
 
type  ring
 

Variables

logical pbc =.false.
 
logical frac =.false.
 
logical nohp =.false.
 
logical abab =.false.
 
logical aaaa =.false.
 
logical acac =.false.
 
logical isolated =.false.
 
logical tomo =.false.
 
logical calc_rings =.false.
 
logical calc_r0 =.false.
 
logical calc_r1 =.false.
 
logical calc_r2 =.false.
 
logical calc_r3 =.false.
 
logical calc_r4 =.false.
 
logical calc_prings =.false.
 
logical calc_strings =.false.
 
logical ring_p1 =.false.
 
logical ring_p2 =.false.
 
logical ring_p3 =.false.
 
logical ring_p4 =.false.
 
logical ring_p5 =.false.
 
logical overall_cubic =.false.
 
logical factatring =.false.
 
logical factatpna =.false.
 
logical factatrmax =.false.
 
logical factatrmin =.false.
 
logical runsearch
 
logical addspec
 
logical doampat =.false.
 
logical saut
 
logical ssaut
 
logical found
 
logical pathout
 
logical firr
 
logical pirr
 
logical homo
 
logical dosearch
 
logical tbr =.false.
 
logical alc =.false.
 
logical no_homo =.false.
 
logical allrings =.false.
 
integer h =0
 
integer i =0
 
integer j =0
 
integer k =0
 
integer l =0
 
integer m =0
 
integer n =0
 
integer o =0
 
integer p =0
 
integer r =0
 
integer t =0
 
integer u =0
 
integer v =0
 
integer noa
 
integer nob
 
integer noc
 
integer nod
 
integer noe
 
integer counter
 
integer rate_count
 
integer max_count
 
integer nsub
 
integer ntsub
 
integer tsub
 
integer err
 
integer nl
 
integer nc
 
integer nsi
 
integer nsj
 
integer number_of_i
 
integer dtv
 
integer nbonds
 
integer anbonds
 
integer ndx
 
integer nbx
 
integer idr
 
integer gr_index
 
integer sum_index
 
integer ang_i
 
integer finish
 
integer indexmsf
 
integer id1
 
integer id2
 
integer id
 
integer gtbsize
 
integer spirr
 
integer l_tot
 
integer la_tot
 
integer numa
 
integer sc
 
integer path
 
integer nnp
 
integer nna
 
integer loa
 
integer lob
 
integer loc
 
integer maxat
 
integer minat
 
integer maxst
 
integer minst
 
integer grnum
 
integer sqnum
 
integer sknum
 
integer gqnum
 
integer bdnum
 
integer annum
 
integer rinum
 
integer chnum
 
integer shnum
 
integer msnum
 
integer ab
 
integer abc
 
integer na
 
integer number_of_a
 
integer nsp
 
integer nsp_by_step
 
integer ns
 
integer nos
 
integer nstp
 
integer nsbg
 
integer taillr
 
integer tailld
 
integer taille
 
integer taillh
 
integer taillt
 
integer taillc
 
integer tlt
 
integer ntlt
 
integer number_of_qmod
 
integer number_of_qvect
 
integer ltlt
 
integer ncells
 
integer idgr =0
 
integer idsq =1
 
integer idsk =2
 
integer idgrfft =3
 
integer idbd =4
 
integer idan =5
 
integer idri =6
 
integer idch =7
 
integer idsp =8
 
integer idmsd =9
 
integer maxn =20
 
integer molats
 
integer molstep
 
integer molcounter
 
integer tmbs
 
integer, dimension(:), allocatable lot
 
integer, dimension(:), allocatable nbspbs
 
integer, dimension(:), allocatable atomid
 
integer, dimension(3) isize
 
integer, dimension(:), allocatable degeneracy
 
integer, dimension(:), allocatable mibs
 
integer, dimension(:), allocatable tot_gsa
 
integer, dimension(:), allocatable ntetra
 
integer, dimension(:), allocatable lp_geom
 
integer, dimension(:), allocatable togl
 
integer, dimension(:), allocatable tigl
 
integer, dimension(:), allocatable lgsa
 
integer, dimension(:), allocatable ngsa
 
integer, dimension(:), allocatable rpat
 
integer, dimension(:), allocatable cpat
 
integer, dimension(:), allocatable mol_atoms
 
integer, dimension(:), allocatable res_list
 
integer, dimension(:), allocatable apna
 
integer, dimension(:), allocatable spna
 
integer, dimension(:), allocatable valid
 
integer, dimension(:), allocatable queue
 
integer, dimension(:), allocatable ringstat
 
integer, dimension(:), allocatable npring
 
integer, dimension(:), allocatable matdist
 
integer, dimension(:,:), allocatable lt_geom
 
integer, dimension(:,:), allocatable geom_la
 
integer, dimension(:,:), allocatable tot_geomsa
 
integer, dimension(:,:), allocatable tetra
 
integer, dimension(:,:), allocatable tiida
 
integer, dimension(:,:), allocatable tisp
 
integer, dimension(:,:), allocatable contj
 
integer, dimension(:,:), allocatable cort
 
integer, dimension(:,:), allocatable edget
 
integer, dimension(:,:), allocatable deft
 
integer, dimension(:,:), allocatable corta
 
integer, dimension(:,:), allocatable edgeta
 
integer, dimension(:,:), allocatable defta
 
integer, dimension(:,:), allocatable tda
 
integer, dimension(:,:), allocatable, target indr
 
integer, dimension(:,:), allocatable, target nring
 
integer, dimension(:,:), allocatable vpat
 
integer, dimension(:,:), allocatable indrat
 
integer, dimension(:,:), allocatable nirrat
 
integer, dimension(:,:), allocatable nirr
 
integer, dimension(:,:), allocatable atrmsx
 
integer, dimension(:,:), allocatable atrmsn
 
integer, dimension(:,:), allocatable ampat
 
integer, dimension(:,:), allocatable atrmax
 
integer, dimension(:,:), allocatable atrmin
 
integer, dimension(:,:), allocatable maxpna
 
integer, dimension(:,:), allocatable minpna
 
integer, dimension(:,:), allocatable pring
 
integer, dimension(:,:), allocatable querng
 
integer, dimension(:,:), allocatable vref
 
integer, dimension(:,:), allocatable pringord
 
integer, dimension(:,:,:), allocatable la_count
 
integer, dimension(:,:,:), allocatable corner
 
integer, dimension(:,:,:), allocatable edge
 
integer, dimension(:,:,:), allocatable def
 
integer, dimension(:,:,:), allocatable cornera
 
integer, dimension(:,:,:), allocatable edgea
 
integer, dimension(:,:,:), allocatable defa
 
integer, dimension(:,:,:), allocatable tdsa
 
integer, dimension(:,:,:), allocatable voisj
 
integer, dimension(:,:,:), allocatable statbd
 
integer, dimension(:,:,:), allocatable indring
 
integer, dimension(:,:,:), allocatable indsring
 
integer, dimension(:,:,:), allocatable lirr
 
integer, dimension(:,:,:), allocatable atring
 
integer, dimension(:,:,:), allocatable atpna
 
integer, dimension(:,:,:), allocatable matpna
 
integer, dimension(:,:,:), allocatable stpna
 
integer, dimension(:,:,:), allocatable pna
 
integer, dimension(:,:,:), allocatable sna
 
integer, dimension(:,:,:), allocatable, target ringsaved
 
integer, dimension(:,:,:), allocatable, target sringsaved
 
integer, dimension(:,:,:,:), allocatable, target ringord
 
integer, dimension(:,:,:,:), allocatable, target sringord
 
character(len=15) sdate
 
character(len=15) stime
 
character(len=15) szone
 
character(len=15) edate
 
character(len=15) etime
 
character(len=15) ezone
 
character(len=9) progname ="ATOMES"
 
character(len=2) choose
 
character(len=2) a1
 
character(len=2) a2
 
character(len=2) atot
 
character(len=20) nom_tmp
 
character(len=15) ntmp
 
character(len=15) ntmp2
 
character(len=15) ntmp3
 
character(len=15) nstep
 
character(len=15) nomx
 
character(len=15) nomy
 
character(len=15) nom
 
character(len=15) nom1
 
character(len=15) nom2
 
character(len=15) nom3
 
character(len=15) nom4
 
character(len=40) nomsys
 
character(len=40) noms
 
character(len=16) spind
 
character(len=20) alc_tab
 
character(len=2), dimension(:), allocatable tl
 
character(len=2), dimension(:), allocatable ftab
 
character(len=2), dimension(:), allocatable tab_of_type
 
character(len=2), dimension(:), allocatable label
 
character(len=15), dimension(:), allocatable elemid
 
character(len=12), dimension(:,:), allocatable liste_geoms
 
character(len=12), dimension(:,:,:), allocatable lgeo
 
double precision ltemp
 
double precision w =0.0d0
 
double precision x =0.0d0
 
double precision y =0.0d0
 
double precision z =0.0d0
 
double precision, parameter pi =acos(-1.0)
 
double precision, parameter avogadro =6.02214179d0
 
double precision, parameter angtobohr =0.52917721
 
double precision p1
 
double precision p2
 
double precision p3
 
double precision time_tot
 
double precision tstat
 
double precision mbox
 
double precision boxs2
 
double precision base
 
double precision teta
 
double precision dc
 
double precision delta_ang
 
double precision meanvol
 
double precision total_density
 
double precision real_density
 
double precision freevol
 
double precision ecfreev
 
double precision dij
 
double precision dil
 
double precision vij
 
double precision gr_cutoff
 
double precision cutf
 
double precision phi
 
double precision sinus_phi
 
double precision norm_tot
 
double precision delta_q
 
double precision rmax
 
double precision sinus_fact_rmax
 
double precision fact_rmax
 
double precision sigma_liss
 
double precision qvmod
 
double precision qvmax
 
double precision qvmin
 
double precision, dimension(3) rij
 
double precision, dimension(3) ril
 
double precision, dimension(3) rim
 
double precision, dimension(3) dab
 
double precision, dimension(3) var
 
double precision, dimension(3) r2ij
 
double precision, dimension(3) r2cor
 
double precision, dimension(3) rcm
 
double precision, dimension(3) rcm2
 
double precision, dimension(:), allocatable s_length
 
double precision, dimension(:), allocatable mass
 
double precision, dimension(:), allocatable m_ss
 
double precision, dimension(:), allocatable rvdw
 
double precision, dimension(:), allocatable r_dw
 
double precision, dimension(:), allocatable dcte
 
double precision, dimension(:), allocatable dist_ij
 
double precision, dimension(:), allocatable dist_ji
 
double precision, dimension(:), allocatable cmoy
 
double precision, dimension(:), allocatable xi
 
double precision, dimension(:), allocatable mtabl
 
double precision, dimension(3) cutfv
 
double precision, dimension(3) pmin
 
double precision, dimension(3) pmax
 
double precision, dimension(:), allocatable mac
 
double precision, dimension(:), allocatable sa_count
 
double precision, dimension(:), allocatable eabl
 
double precision, dimension(:), allocatable cabl
 
double precision, dimension(:), allocatable dabl
 
double precision, dimension(:), allocatable etabl
 
double precision, dimension(:), allocatable ctabl
 
double precision, dimension(:), allocatable dtabl
 
double precision, dimension(:), allocatable ectabl
 
double precision, dimension(:), allocatable tdtabl
 
double precision, dimension(:), allocatable r_point
 
double precision, dimension(:), allocatable grtab
 
double precision, dimension(:), allocatable grtot
 
double precision, dimension(:), allocatable ggrtot
 
double precision, dimension(:), allocatable drn
 
double precision, dimension(:), allocatable trn
 
double precision, dimension(:), allocatable xgrtot
 
double precision, dimension(:), allocatable xggrtot
 
double precision, dimension(:), allocatable drx
 
double precision, dimension(:), allocatable trx
 
double precision, dimension(:), allocatable shell_vol
 
double precision, dimension(2) gd
 
double precision, dimension(2) gn
 
double precision, dimension(2) go
 
double precision, dimension(2) c_box
 
double precision, dimension(:), allocatable nscattl
 
double precision, dimension(:), allocatable xscattl
 
double precision, dimension(:), allocatable s
 
double precision, dimension(:), allocatable xs
 
double precision, dimension(:), allocatable gr_t
 
double precision, dimension(:), allocatable q_point
 
double precision, dimension(:), allocatable k_point
 
double precision, dimension(:), allocatable fnbspbs
 
double precision, dimension(:), allocatable modq
 
double precision, dimension(:), allocatable qvectx
 
double precision, dimension(:), allocatable qvecty
 
double precision, dimension(:), allocatable qvectz
 
double precision, dimension(:), allocatable cij
 
double precision, dimension(:), allocatable sik
 
double precision, dimension(:), allocatable gfft
 
double precision, dimension(:), allocatable dfft
 
double precision, dimension(:), allocatable r_pfft
 
double precision, dimension(:), allocatable tdfft
 
double precision, dimension(:), allocatable moypur
 
double precision, dimension(:), allocatable moyred
 
double precision, dimension(:), allocatable moypat
 
double precision, dimension(:), allocatable moyrat
 
double precision, dimension(:), allocatable ectype
 
double precision, dimension(:), allocatable ectyp
 
double precision, dimension(:), allocatable ectypat
 
double precision, dimension(:), allocatable ectat
 
double precision, dimension(:), allocatable irred
 
double precision, dimension(:), allocatable red
 
double precision, dimension(:), allocatable redat
 
double precision, dimension(:), allocatable irrat
 
double precision, dimension(:), allocatable totpstep
 
double precision, dimension(:), allocatable rnamax
 
double precision, dimension(:), allocatable rnamin
 
double precision, dimension(:), allocatable evmax
 
double precision, dimension(:), allocatable evmin
 
double precision, dimension(:,:), allocatable epna
 
double precision, dimension(:,:), allocatable poa
 
double precision, dimension(:,:), allocatable pob
 
double precision, dimension(:,:), allocatable ma_count
 
double precision, dimension(:,:), allocatable num_gsa
 
double precision, dimension(:,:), allocatable gr_cut
 
double precision, dimension(:,:), allocatable gr_tmp
 
double precision, dimension(:,:), allocatable btij
 
double precision, dimension(:,:), allocatable etype
 
double precision, dimension(:,:), allocatable ctype
 
double precision, dimension(:,:), allocatable detype
 
double precision, dimension(:,:), allocatable etypea
 
double precision, dimension(:,:), allocatable ctypea
 
double precision, dimension(:,:), allocatable detypea
 
double precision, dimension(:,:), allocatable etda
 
double precision, dimension(:,:), allocatable qvect
 
double precision, dimension(:,:), allocatable drift
 
double precision, dimension(:,:), allocatable cor
 
double precision, dimension(:,:), allocatable d2i
 
double precision, dimension(:,:), allocatable d2inac
 
double precision, dimension(:,:,:), allocatable fullpos
 
double precision, dimension(:,:,:), allocatable fullvel
 
double precision, dimension(:,:,:), allocatable nfullpos
 
double precision, dimension(:,:,:), allocatable nfpos
 
double precision, dimension(:,:,:), allocatable ecart_type
 
double precision, dimension(:,:,:), allocatable gr_ij
 
double precision, dimension(:,:,:), allocatable ggr_ij
 
double precision, dimension(:,:,:), allocatable dn_ij
 
double precision, dimension(:,:,:), allocatable gqbt
 
double precision, dimension(:,:,:), allocatable sij
 
double precision, dimension(:,:,:), allocatable spij
 
double precision, dimension(:,:,:), allocatable ss_ij
 
double precision, dimension(:,:,:), allocatable fzsij
 
double precision, dimension(:,:,:), allocatable d2ij
 
double precision, dimension(:,:,:), allocatable d2ijnac
 
double precision, dimension(:,:,:), allocatable d2dir
 
double precision, dimension(:,:,:), allocatable d2dirnac
 
double precision, dimension(:,:,:), allocatable cornac
 
double precision, dimension(:,:,:,:), allocatable gij
 
double precision, dimension(:,:,:,:), allocatable dn
 
type(pixel), dimension(:), allocatable thepix
 
type(pixel), dimension(:), allocatable testpix
 
type(lattice), dimension(:), allocatable, target the_box
 
type(lattice), pointer nbox
 

Variable Documentation

◆ a1

character (len=2) a1

Definition at line 341 of file parameters.F90.

◆ a2

character (len=2) a2

Definition at line 341 of file parameters.F90.

◆ aaaa

logical aaaa =.false.

Definition at line 71 of file parameters.F90.

◆ ab

integer ab

Definition at line 142 of file parameters.F90.

◆ abab

logical abab =.false.

Definition at line 70 of file parameters.F90.

◆ abc

integer abc

Definition at line 142 of file parameters.F90.

◆ acac

logical acac =.false.

Definition at line 72 of file parameters.F90.

◆ addspec

logical addspec

Definition at line 100 of file parameters.F90.

◆ alc

logical alc =.false.

Definition at line 109 of file parameters.F90.

◆ alc_tab

character (len=20) alc_tab

Definition at line 348 of file parameters.F90.

◆ allrings

logical allrings =.false.

Definition at line 111 of file parameters.F90.

◆ ampat

integer, dimension(:,:), allocatable ampat

Definition at line 264 of file parameters.F90.

◆ anbonds

integer anbonds

Definition at line 127 of file parameters.F90.

◆ ang_i

integer ang_i

Definition at line 131 of file parameters.F90.

◆ angtobohr

double precision, parameter angtobohr =0.52917721

Definition at line 398 of file parameters.F90.

◆ annum

integer annum

Definition at line 141 of file parameters.F90.

◆ apna

integer, dimension(:), allocatable apna

Definition at line 221 of file parameters.F90.

◆ atomid

integer, dimension(:), allocatable atomid

Definition at line 191 of file parameters.F90.

◆ atot

character (len=2) atot

Definition at line 342 of file parameters.F90.

◆ atpna

integer, dimension(:,:,:), allocatable atpna

Definition at line 303 of file parameters.F90.

◆ atring

integer, dimension(:,:,:), allocatable atring

Definition at line 303 of file parameters.F90.

◆ atrmax

integer, dimension(:,:), allocatable atrmax

Definition at line 264 of file parameters.F90.

◆ atrmin

integer, dimension(:,:), allocatable atrmin

Definition at line 264 of file parameters.F90.

◆ atrmsn

integer, dimension(:,:), allocatable atrmsn

Definition at line 263 of file parameters.F90.

◆ atrmsx

integer, dimension(:,:), allocatable atrmsx

Definition at line 263 of file parameters.F90.

◆ avogadro

double precision, parameter avogadro =6.02214179d0

Definition at line 397 of file parameters.F90.

◆ base

double precision base

Definition at line 403 of file parameters.F90.

◆ bdnum

integer bdnum

Definition at line 141 of file parameters.F90.

◆ boxs2

double precision boxs2

Definition at line 402 of file parameters.F90.

◆ btij

double precision, dimension(:,:), allocatable btij

Definition at line 518 of file parameters.F90.

◆ c_box

double precision, dimension(2) c_box

Definition at line 471 of file parameters.F90.

◆ cabl

double precision, dimension(:), allocatable cabl

Definition at line 455 of file parameters.F90.

◆ calc_prings

logical calc_prings =.false.

Definition at line 81 of file parameters.F90.

◆ calc_r0

logical calc_r0 =.false.

Definition at line 76 of file parameters.F90.

◆ calc_r1

logical calc_r1 =.false.

Definition at line 77 of file parameters.F90.

◆ calc_r2

logical calc_r2 =.false.

Definition at line 78 of file parameters.F90.

◆ calc_r3

logical calc_r3 =.false.

Definition at line 79 of file parameters.F90.

◆ calc_r4

logical calc_r4 =.false.

Definition at line 80 of file parameters.F90.

◆ calc_rings

logical calc_rings =.false.

Definition at line 75 of file parameters.F90.

◆ calc_strings

logical calc_strings =.false.

Definition at line 82 of file parameters.F90.

◆ chnum

integer chnum

Definition at line 141 of file parameters.F90.

◆ choose

character (len=2) choose

Definition at line 340 of file parameters.F90.

◆ cij

double precision, dimension(:), allocatable cij

Definition at line 483 of file parameters.F90.

◆ cmoy

double precision, dimension(:), allocatable cmoy

Definition at line 440 of file parameters.F90.

◆ contj

integer, dimension(:,:), allocatable contj

Definition at line 245 of file parameters.F90.

◆ cor

double precision, dimension(:,:), allocatable cor

Definition at line 536 of file parameters.F90.

◆ cornac

double precision, dimension(:,:,:), allocatable cornac

Definition at line 573 of file parameters.F90.

◆ corner

integer, dimension(:,:,:), allocatable corner

Definition at line 284 of file parameters.F90.

◆ cornera

integer, dimension(:,:,:), allocatable cornera

Definition at line 287 of file parameters.F90.

◆ cort

integer, dimension(:,:), allocatable cort

Definition at line 249 of file parameters.F90.

◆ corta

integer, dimension(:,:), allocatable corta

Definition at line 252 of file parameters.F90.

◆ counter

integer counter

Definition at line 122 of file parameters.F90.

◆ cpat

integer, dimension(:), allocatable cpat

Definition at line 215 of file parameters.F90.

◆ ctabl

double precision, dimension(:), allocatable ctabl

Definition at line 456 of file parameters.F90.

◆ ctype

double precision, dimension(:,:), allocatable ctype

Definition at line 523 of file parameters.F90.

◆ ctypea

double precision, dimension(:,:), allocatable ctypea

Definition at line 526 of file parameters.F90.

◆ cutf

double precision cutf

Definition at line 412 of file parameters.F90.

◆ cutfv

double precision, dimension(3) cutfv

Definition at line 445 of file parameters.F90.

◆ d2dir

double precision, dimension(:,:,:), allocatable d2dir

Definition at line 572 of file parameters.F90.

◆ d2dirnac

double precision, dimension(:,:,:), allocatable d2dirnac

Definition at line 572 of file parameters.F90.

◆ d2i

double precision, dimension(:,:), allocatable d2i

Definition at line 537 of file parameters.F90.

◆ d2ij

double precision, dimension(:,:,:), allocatable d2ij

Definition at line 572 of file parameters.F90.

◆ d2ijnac

double precision, dimension(:,:,:), allocatable d2ijnac

Definition at line 572 of file parameters.F90.

◆ d2inac

double precision, dimension(:,:), allocatable d2inac

Definition at line 537 of file parameters.F90.

◆ dab

double precision, dimension(3) dab

Definition at line 433 of file parameters.F90.

◆ dabl

double precision, dimension(:), allocatable dabl

Definition at line 455 of file parameters.F90.

◆ dc

double precision dc

Definition at line 405 of file parameters.F90.

◆ dcte

double precision, dimension(:), allocatable dcte

Definition at line 438 of file parameters.F90.

◆ def

integer, dimension(:,:,:), allocatable def

Definition at line 286 of file parameters.F90.

◆ defa

integer, dimension(:,:,:), allocatable defa

Definition at line 289 of file parameters.F90.

◆ deft

integer, dimension(:,:), allocatable deft

Definition at line 251 of file parameters.F90.

◆ defta

integer, dimension(:,:), allocatable defta

Definition at line 254 of file parameters.F90.

◆ degeneracy

integer, dimension(:), allocatable degeneracy

Definition at line 199 of file parameters.F90.

◆ delta_ang

double precision delta_ang

Definition at line 406 of file parameters.F90.

◆ delta_q

double precision delta_q

Definition at line 421 of file parameters.F90.

◆ detype

double precision, dimension(:,:), allocatable detype

Definition at line 524 of file parameters.F90.

◆ detypea

double precision, dimension(:,:), allocatable detypea

Definition at line 527 of file parameters.F90.

◆ dfft

double precision, dimension(:), allocatable dfft

Definition at line 487 of file parameters.F90.

◆ dij

double precision dij

Definition at line 410 of file parameters.F90.

◆ dil

double precision dil

Definition at line 410 of file parameters.F90.

◆ dist_ij

double precision, dimension(:), allocatable dist_ij

Definition at line 439 of file parameters.F90.

◆ dist_ji

double precision, dimension(:), allocatable dist_ji

Definition at line 439 of file parameters.F90.

◆ dn

double precision, dimension(:,:,:,:), allocatable dn

Definition at line 583 of file parameters.F90.

◆ dn_ij

double precision, dimension(:,:,:), allocatable dn_ij

Definition at line 555 of file parameters.F90.

◆ doampat

logical doampat =.false.

Definition at line 101 of file parameters.F90.

◆ dosearch

logical dosearch

Definition at line 107 of file parameters.F90.

◆ drift

double precision, dimension(:,:), allocatable drift

Definition at line 536 of file parameters.F90.

◆ drn

double precision, dimension(:), allocatable drn

Definition at line 464 of file parameters.F90.

◆ drx

double precision, dimension(:), allocatable drx

Definition at line 466 of file parameters.F90.

◆ dtabl

double precision, dimension(:), allocatable dtabl

Definition at line 456 of file parameters.F90.

◆ dtv

integer dtv

Definition at line 126 of file parameters.F90.

◆ eabl

double precision, dimension(:), allocatable eabl

Definition at line 455 of file parameters.F90.

◆ ecart_type

double precision, dimension(:,:,:), allocatable ecart_type

Definition at line 549 of file parameters.F90.

◆ ecfreev

double precision ecfreev

Definition at line 409 of file parameters.F90.

◆ ectabl

double precision, dimension(:), allocatable ectabl

Definition at line 457 of file parameters.F90.

◆ ectat

double precision, dimension(:), allocatable ectat

Definition at line 493 of file parameters.F90.

◆ ectyp

double precision, dimension(:), allocatable ectyp

Definition at line 493 of file parameters.F90.

◆ ectypat

double precision, dimension(:), allocatable ectypat

Definition at line 493 of file parameters.F90.

◆ ectype

double precision, dimension(:), allocatable ectype

Definition at line 493 of file parameters.F90.

◆ edate

character (len=15) edate

Definition at line 335 of file parameters.F90.

◆ edge

integer, dimension(:,:,:), allocatable edge

Definition at line 285 of file parameters.F90.

◆ edgea

integer, dimension(:,:,:), allocatable edgea

Definition at line 288 of file parameters.F90.

◆ edget

integer, dimension(:,:), allocatable edget

Definition at line 250 of file parameters.F90.

◆ edgeta

integer, dimension(:,:), allocatable edgeta

Definition at line 253 of file parameters.F90.

◆ elemid

character (len=15), dimension(:), allocatable elemid

Definition at line 363 of file parameters.F90.

◆ epna

double precision, dimension(:,:), allocatable epna

Definition at line 507 of file parameters.F90.

◆ err

integer err

Definition at line 123 of file parameters.F90.

◆ etabl

double precision, dimension(:), allocatable etabl

Definition at line 456 of file parameters.F90.

◆ etda

double precision, dimension(:,:), allocatable etda

Definition at line 528 of file parameters.F90.

◆ etime

character (len=15) etime

Definition at line 335 of file parameters.F90.

◆ etype

double precision, dimension(:,:), allocatable etype

Definition at line 522 of file parameters.F90.

◆ etypea

double precision, dimension(:,:), allocatable etypea

Definition at line 525 of file parameters.F90.

◆ evmax

double precision, dimension(:), allocatable evmax

Definition at line 498 of file parameters.F90.

◆ evmin

double precision, dimension(:), allocatable evmin

Definition at line 498 of file parameters.F90.

◆ ezone

character (len=15) ezone

Definition at line 335 of file parameters.F90.

◆ fact_rmax

double precision fact_rmax

Definition at line 422 of file parameters.F90.

◆ factatpna

logical factatpna =.false.

Definition at line 96 of file parameters.F90.

◆ factatring

logical factatring =.false.

Definition at line 95 of file parameters.F90.

◆ factatrmax

logical factatrmax =.false.

Definition at line 97 of file parameters.F90.

◆ factatrmin

logical factatrmin =.false.

Definition at line 98 of file parameters.F90.

◆ finish

integer finish

Definition at line 132 of file parameters.F90.

◆ firr

logical firr

Definition at line 105 of file parameters.F90.

◆ fnbspbs

double precision, dimension(:), allocatable fnbspbs

Definition at line 480 of file parameters.F90.

◆ found

logical found

Definition at line 103 of file parameters.F90.

◆ frac

logical frac =.false.

Definition at line 68 of file parameters.F90.

◆ freevol

double precision freevol

Definition at line 409 of file parameters.F90.

◆ ftab

character (len=2), dimension(:), allocatable ftab

Definition at line 357 of file parameters.F90.

◆ fullpos

double precision, dimension(:,:,:), allocatable fullpos

Definition at line 546 of file parameters.F90.

◆ fullvel

double precision, dimension(:,:,:), allocatable fullvel

Definition at line 547 of file parameters.F90.

◆ fzsij

double precision, dimension(:,:,:), allocatable fzsij

Definition at line 568 of file parameters.F90.

◆ gd

double precision, dimension(2) gd

Definition at line 471 of file parameters.F90.

◆ geom_la

integer, dimension(:,:), allocatable geom_la

Definition at line 234 of file parameters.F90.

◆ gfft

double precision, dimension(:), allocatable gfft

Definition at line 487 of file parameters.F90.

◆ ggr_ij

double precision, dimension(:,:,:), allocatable ggr_ij

Definition at line 554 of file parameters.F90.

◆ ggrtot

double precision, dimension(:), allocatable ggrtot

Definition at line 463 of file parameters.F90.

◆ gij

double precision, dimension(:,:,:,:), allocatable gij

Definition at line 582 of file parameters.F90.

◆ gn

double precision, dimension(2) gn

Definition at line 471 of file parameters.F90.

◆ go

double precision, dimension(2) go

Definition at line 471 of file parameters.F90.

◆ gqbt

double precision, dimension(:,:,:), allocatable gqbt

Definition at line 559 of file parameters.F90.

◆ gqnum

integer gqnum

Definition at line 141 of file parameters.F90.

◆ gr_cut

double precision, dimension(:,:), allocatable gr_cut

Definition at line 514 of file parameters.F90.

◆ gr_cutoff

double precision gr_cutoff

Definition at line 411 of file parameters.F90.

◆ gr_ij

double precision, dimension(:,:,:), allocatable gr_ij

Definition at line 553 of file parameters.F90.

◆ gr_index

integer gr_index

Definition at line 129 of file parameters.F90.

◆ gr_t

double precision, dimension(:), allocatable gr_t

Definition at line 475 of file parameters.F90.

◆ gr_tmp

double precision, dimension(:,:), allocatable gr_tmp

Definition at line 514 of file parameters.F90.

◆ grnum

integer grnum

Definition at line 141 of file parameters.F90.

◆ grtab

double precision, dimension(:), allocatable grtab

Definition at line 462 of file parameters.F90.

◆ grtot

double precision, dimension(:), allocatable grtot

Definition at line 463 of file parameters.F90.

◆ gtbsize

integer gtbsize

Definition at line 133 of file parameters.F90.

◆ h

integer h =0

Definition at line 120 of file parameters.F90.

◆ homo

logical homo

Definition at line 106 of file parameters.F90.

◆ i

integer i =0

Definition at line 120 of file parameters.F90.

◆ id

integer id

Definition at line 133 of file parameters.F90.

◆ id1

integer id1

Definition at line 133 of file parameters.F90.

◆ id2

integer id2

Definition at line 133 of file parameters.F90.

◆ idan

integer idan =5

Definition at line 164 of file parameters.F90.

◆ idbd

integer idbd =4

Definition at line 163 of file parameters.F90.

◆ idch

integer idch =7

Definition at line 166 of file parameters.F90.

◆ idgr

integer idgr =0

Definition at line 159 of file parameters.F90.

◆ idgrfft

integer idgrfft =3

Definition at line 162 of file parameters.F90.

◆ idmsd

integer idmsd =9

Definition at line 168 of file parameters.F90.

◆ idr

integer idr

Definition at line 128 of file parameters.F90.

◆ idri

integer idri =6

Definition at line 165 of file parameters.F90.

◆ idsk

integer idsk =2

Definition at line 161 of file parameters.F90.

◆ idsp

integer idsp =8

Definition at line 167 of file parameters.F90.

◆ idsq

integer idsq =1

Definition at line 160 of file parameters.F90.

◆ indexmsf

integer indexmsf

Definition at line 132 of file parameters.F90.

◆ indr

integer, dimension(:,:), allocatable, target indr

Definition at line 259 of file parameters.F90.

◆ indrat

integer, dimension(:,:), allocatable indrat

Definition at line 262 of file parameters.F90.

◆ indring

integer, dimension(:,:,:), allocatable indring

Definition at line 302 of file parameters.F90.

◆ indsring

integer, dimension(:,:,:), allocatable indsring

Definition at line 302 of file parameters.F90.

◆ irrat

double precision, dimension(:), allocatable irrat

Definition at line 495 of file parameters.F90.

◆ irred

double precision, dimension(:), allocatable irred

Definition at line 494 of file parameters.F90.

◆ isize

integer, dimension(3) isize

Definition at line 195 of file parameters.F90.

◆ isolated

logical isolated =.false.

Definition at line 73 of file parameters.F90.

◆ j

integer j =0

Definition at line 120 of file parameters.F90.

◆ k

integer k =0

Definition at line 120 of file parameters.F90.

◆ k_point

double precision, dimension(:), allocatable k_point

Definition at line 476 of file parameters.F90.

◆ l

integer l =0

Definition at line 120 of file parameters.F90.

◆ l_tot

integer l_tot

Definition at line 135 of file parameters.F90.

◆ la_count

integer, dimension(:,:,:), allocatable la_count

Definition at line 280 of file parameters.F90.

◆ la_tot

integer la_tot

Definition at line 135 of file parameters.F90.

◆ label

character (len=2), dimension(:), allocatable label

Definition at line 359 of file parameters.F90.

◆ lgeo

character (len=12), dimension(:,:,:), allocatable lgeo

Definition at line 377 of file parameters.F90.

◆ lgsa

integer, dimension(:), allocatable lgsa

Definition at line 211 of file parameters.F90.

◆ lirr

integer, dimension(:,:,:), allocatable lirr

Definition at line 302 of file parameters.F90.

◆ liste_geoms

character (len=12), dimension(:,:), allocatable liste_geoms

Definition at line 370 of file parameters.F90.

◆ loa

integer loa

Definition at line 138 of file parameters.F90.

◆ lob

integer lob

Definition at line 138 of file parameters.F90.

◆ loc

integer loc

Definition at line 138 of file parameters.F90.

◆ lot

integer, dimension(:), allocatable lot

Definition at line 186 of file parameters.F90.

◆ lp_geom

integer, dimension(:), allocatable lp_geom

Definition at line 209 of file parameters.F90.

◆ lt_geom

integer, dimension(:,:), allocatable lt_geom

Definition at line 233 of file parameters.F90.

◆ ltemp

double precision ltemp

Definition at line 385 of file parameters.F90.

◆ ltlt

integer ltlt

Definition at line 156 of file parameters.F90.

◆ m

integer m =0

Definition at line 120 of file parameters.F90.

◆ m_ss

double precision, dimension(:), allocatable m_ss

Definition at line 436 of file parameters.F90.

◆ ma_count

double precision, dimension(:,:), allocatable ma_count

Definition at line 512 of file parameters.F90.

◆ mac

double precision, dimension(:), allocatable mac

Definition at line 450 of file parameters.F90.

◆ mass

double precision, dimension(:), allocatable mass

Definition at line 436 of file parameters.F90.

◆ matdist

integer, dimension(:), allocatable matdist

Definition at line 227 of file parameters.F90.

◆ matpna

integer, dimension(:,:,:), allocatable matpna

Definition at line 303 of file parameters.F90.

◆ max_count

integer max_count

Definition at line 122 of file parameters.F90.

◆ maxat

integer maxat

Definition at line 139 of file parameters.F90.

◆ maxn

integer maxn =20

Definition at line 170 of file parameters.F90.

◆ maxpna

integer, dimension(:,:), allocatable maxpna

Definition at line 265 of file parameters.F90.

◆ maxst

integer maxst

Definition at line 140 of file parameters.F90.

◆ mbox

double precision mbox

Definition at line 401 of file parameters.F90.

◆ meanvol

double precision meanvol

Definition at line 407 of file parameters.F90.

◆ mibs

integer, dimension(:), allocatable mibs

Definition at line 203 of file parameters.F90.

◆ minat

integer minat

Definition at line 139 of file parameters.F90.

◆ minpna

integer, dimension(:,:), allocatable minpna

Definition at line 265 of file parameters.F90.

◆ minst

integer minst

Definition at line 140 of file parameters.F90.

◆ modq

double precision, dimension(:), allocatable modq

Definition at line 481 of file parameters.F90.

◆ mol_atoms

integer, dimension(:), allocatable mol_atoms

Definition at line 216 of file parameters.F90.

◆ molats

integer molats

Definition at line 174 of file parameters.F90.

◆ molcounter

integer molcounter

Definition at line 176 of file parameters.F90.

◆ molstep

integer molstep

Definition at line 175 of file parameters.F90.

◆ moypat

double precision, dimension(:), allocatable moypat

Definition at line 492 of file parameters.F90.

◆ moypur

double precision, dimension(:), allocatable moypur

Definition at line 491 of file parameters.F90.

◆ moyrat

double precision, dimension(:), allocatable moyrat

Definition at line 492 of file parameters.F90.

◆ moyred

double precision, dimension(:), allocatable moyred

Definition at line 491 of file parameters.F90.

◆ msnum

integer msnum

Definition at line 141 of file parameters.F90.

◆ mtabl

double precision, dimension(:), allocatable mtabl

Definition at line 441 of file parameters.F90.

◆ n

integer n =0

Definition at line 120 of file parameters.F90.

◆ na

integer na

Definition at line 146 of file parameters.F90.

◆ nbonds

integer nbonds

Definition at line 127 of file parameters.F90.

◆ nbox

type (lattice), pointer nbox

Definition at line 668 of file parameters.F90.

◆ nbspbs

integer, dimension(:), allocatable nbspbs

Definition at line 187 of file parameters.F90.

◆ nbx

integer nbx

Definition at line 128 of file parameters.F90.

◆ nc

integer nc

Definition at line 124 of file parameters.F90.

◆ ncells

integer ncells

Definition at line 157 of file parameters.F90.

◆ ndx

integer ndx

Definition at line 128 of file parameters.F90.

◆ nfpos

double precision, dimension(:,:,:), allocatable nfpos

Definition at line 548 of file parameters.F90.

◆ nfullpos

double precision, dimension(:,:,:), allocatable nfullpos

Definition at line 548 of file parameters.F90.

◆ ngsa

integer, dimension(:), allocatable ngsa

Definition at line 211 of file parameters.F90.

◆ nirr

integer, dimension(:,:), allocatable nirr

Definition at line 262 of file parameters.F90.

◆ nirrat

integer, dimension(:,:), allocatable nirrat

Definition at line 262 of file parameters.F90.

◆ nl

integer nl

Definition at line 124 of file parameters.F90.

◆ nna

integer nna

Definition at line 137 of file parameters.F90.

◆ nnp

integer nnp

Definition at line 137 of file parameters.F90.

◆ no_homo

logical no_homo =.false.

Definition at line 110 of file parameters.F90.

◆ noa

integer noa

Definition at line 121 of file parameters.F90.

◆ nob

integer nob

Definition at line 121 of file parameters.F90.

◆ noc

integer noc

Definition at line 121 of file parameters.F90.

◆ nod

integer nod

Definition at line 121 of file parameters.F90.

◆ noe

integer noe

Definition at line 121 of file parameters.F90.

◆ nohp

logical nohp =.false.

Definition at line 69 of file parameters.F90.

◆ nom

character (len=15) nom

Definition at line 345 of file parameters.F90.

◆ nom1

character (len=15) nom1

Definition at line 345 of file parameters.F90.

◆ nom2

character (len=15) nom2

Definition at line 345 of file parameters.F90.

◆ nom3

character (len=15) nom3

Definition at line 345 of file parameters.F90.

◆ nom4

character (len=15) nom4

Definition at line 345 of file parameters.F90.

◆ nom_tmp

character (len=20) nom_tmp

Definition at line 343 of file parameters.F90.

◆ noms

character (len=40) noms

Definition at line 346 of file parameters.F90.

◆ nomsys

character (len=40) nomsys

Definition at line 346 of file parameters.F90.

◆ nomx

character (len=15) nomx

Definition at line 344 of file parameters.F90.

◆ nomy

character (len=15) nomy

Definition at line 344 of file parameters.F90.

◆ norm_tot

double precision norm_tot

Definition at line 421 of file parameters.F90.

◆ nos

integer nos

Definition at line 148 of file parameters.F90.

◆ npring

integer, dimension(:), allocatable npring

Definition at line 227 of file parameters.F90.

◆ nring

integer, dimension(:,:), allocatable, target nring

Definition at line 260 of file parameters.F90.

◆ ns

integer ns

Definition at line 148 of file parameters.F90.

◆ nsbg

integer nsbg

Definition at line 149 of file parameters.F90.

◆ nscattl

double precision, dimension(:), allocatable nscattl

Definition at line 472 of file parameters.F90.

◆ nsi

integer nsi

Definition at line 124 of file parameters.F90.

◆ nsj

integer nsj

Definition at line 124 of file parameters.F90.

◆ nsp

integer nsp

Definition at line 147 of file parameters.F90.

◆ nsp_by_step

integer nsp_by_step

Definition at line 147 of file parameters.F90.

◆ nstep

character (len=15) nstep

Definition at line 344 of file parameters.F90.

◆ nstp

integer nstp

Definition at line 148 of file parameters.F90.

◆ nsub

integer nsub

Definition at line 123 of file parameters.F90.

◆ ntetra

integer, dimension(:), allocatable ntetra

Definition at line 208 of file parameters.F90.

◆ ntlt

integer ntlt

Definition at line 153 of file parameters.F90.

◆ ntmp

character (len=15) ntmp

Definition at line 344 of file parameters.F90.

◆ ntmp2

character (len=15) ntmp2

Definition at line 344 of file parameters.F90.

◆ ntmp3

character (len=15) ntmp3

Definition at line 344 of file parameters.F90.

◆ ntsub

integer ntsub

Definition at line 123 of file parameters.F90.

◆ num_gsa

double precision, dimension(:,:), allocatable num_gsa

Definition at line 513 of file parameters.F90.

◆ numa

integer numa

Definition at line 136 of file parameters.F90.

◆ number_of_a

integer number_of_a

Definition at line 146 of file parameters.F90.

◆ number_of_i

integer number_of_i

Definition at line 125 of file parameters.F90.

◆ number_of_qmod

integer number_of_qmod

Definition at line 154 of file parameters.F90.

◆ number_of_qvect

integer number_of_qvect

Definition at line 155 of file parameters.F90.

◆ o

integer o =0

Definition at line 120 of file parameters.F90.

◆ overall_cubic

logical overall_cubic =.false.

Definition at line 88 of file parameters.F90.

◆ p

integer p =0

Definition at line 120 of file parameters.F90.

◆ p1

double precision p1

Definition at line 399 of file parameters.F90.

◆ p2

double precision p2

Definition at line 399 of file parameters.F90.

◆ p3

double precision p3

Definition at line 399 of file parameters.F90.

◆ path

integer path

Definition at line 137 of file parameters.F90.

◆ pathout

logical pathout

Definition at line 104 of file parameters.F90.

◆ pbc

logical pbc =.false.

Definition at line 67 of file parameters.F90.

◆ phi

double precision phi

Definition at line 417 of file parameters.F90.

◆ pi

double precision, parameter pi =acos(-1.0)

Definition at line 396 of file parameters.F90.

◆ pirr

logical pirr

Definition at line 105 of file parameters.F90.

◆ pmax

double precision, dimension(3) pmax

Definition at line 446 of file parameters.F90.

◆ pmin

double precision, dimension(3) pmin

Definition at line 446 of file parameters.F90.

◆ pna

integer, dimension(:,:,:), allocatable pna

Definition at line 305 of file parameters.F90.

◆ poa

double precision, dimension(:,:), allocatable poa

Definition at line 508 of file parameters.F90.

◆ pob

double precision, dimension(:,:), allocatable pob

Definition at line 508 of file parameters.F90.

◆ pring

integer, dimension(:,:), allocatable pring

Definition at line 269 of file parameters.F90.

◆ pringord

integer, dimension(:,:), allocatable pringord

Definition at line 271 of file parameters.F90.

◆ progname

character (len=9) progname ="ATOMES"

Definition at line 336 of file parameters.F90.

◆ q_point

double precision, dimension(:), allocatable q_point

Definition at line 476 of file parameters.F90.

◆ querng

integer, dimension(:,:), allocatable querng

Definition at line 270 of file parameters.F90.

◆ queue

integer, dimension(:), allocatable queue

Definition at line 226 of file parameters.F90.

◆ qvect

double precision, dimension(:,:), allocatable qvect

Definition at line 532 of file parameters.F90.

◆ qvectx

double precision, dimension(:), allocatable qvectx

Definition at line 482 of file parameters.F90.

◆ qvecty

double precision, dimension(:), allocatable qvecty

Definition at line 482 of file parameters.F90.

◆ qvectz

double precision, dimension(:), allocatable qvectz

Definition at line 482 of file parameters.F90.

◆ qvmax

double precision qvmax

Definition at line 424 of file parameters.F90.

◆ qvmin

double precision qvmin

Definition at line 424 of file parameters.F90.

◆ qvmod

double precision qvmod

Definition at line 424 of file parameters.F90.

◆ r

integer r =0

Definition at line 120 of file parameters.F90.

◆ r2cor

double precision, dimension(3) r2cor

Definition at line 434 of file parameters.F90.

◆ r2ij

double precision, dimension(3) r2ij

Definition at line 434 of file parameters.F90.

◆ r_dw

double precision, dimension(:), allocatable r_dw

Definition at line 437 of file parameters.F90.

◆ r_pfft

double precision, dimension(:), allocatable r_pfft

Definition at line 487 of file parameters.F90.

◆ r_point

double precision, dimension(:), allocatable r_point

Definition at line 461 of file parameters.F90.

◆ rate_count

integer rate_count

Definition at line 122 of file parameters.F90.

◆ rcm

double precision, dimension(3) rcm

Definition at line 434 of file parameters.F90.

◆ rcm2

double precision, dimension(3) rcm2

Definition at line 434 of file parameters.F90.

◆ real_density

double precision real_density

Definition at line 408 of file parameters.F90.

◆ red

double precision, dimension(:), allocatable red

Definition at line 494 of file parameters.F90.

◆ redat

double precision, dimension(:), allocatable redat

Definition at line 495 of file parameters.F90.

◆ res_list

integer, dimension(:), allocatable res_list

Definition at line 220 of file parameters.F90.

◆ rij

double precision, dimension(3) rij

Definition at line 433 of file parameters.F90.

◆ ril

double precision, dimension(3) ril

Definition at line 433 of file parameters.F90.

◆ rim

double precision, dimension(3) rim

Definition at line 433 of file parameters.F90.

◆ ring_p1

logical ring_p1 =.false.

Definition at line 83 of file parameters.F90.

◆ ring_p2

logical ring_p2 =.false.

Definition at line 84 of file parameters.F90.

◆ ring_p3

logical ring_p3 =.false.

Definition at line 85 of file parameters.F90.

◆ ring_p4

logical ring_p4 =.false.

Definition at line 86 of file parameters.F90.

◆ ring_p5

logical ring_p5 =.false.

Definition at line 87 of file parameters.F90.

◆ ringord

integer, dimension(:,:,:,:), allocatable, target ringord

Definition at line 321 of file parameters.F90.

◆ ringsaved

integer, dimension(:,:,:), allocatable, target ringsaved

Definition at line 306 of file parameters.F90.

◆ ringstat

integer, dimension(:), allocatable ringstat

Definition at line 226 of file parameters.F90.

◆ rinum

integer rinum

Definition at line 141 of file parameters.F90.

◆ rmax

double precision rmax

Definition at line 422 of file parameters.F90.

◆ rnamax

double precision, dimension(:), allocatable rnamax

Definition at line 497 of file parameters.F90.

◆ rnamin

double precision, dimension(:), allocatable rnamin

Definition at line 497 of file parameters.F90.

◆ rpat

integer, dimension(:), allocatable rpat

Definition at line 215 of file parameters.F90.

◆ runsearch

logical runsearch

Definition at line 99 of file parameters.F90.

◆ rvdw

double precision, dimension(:), allocatable rvdw

Definition at line 437 of file parameters.F90.

◆ s

double precision, dimension(:), allocatable s

Definition at line 474 of file parameters.F90.

◆ s_length

double precision, dimension(:), allocatable s_length

Definition at line 435 of file parameters.F90.

◆ sa_count

double precision, dimension(:), allocatable sa_count

Definition at line 451 of file parameters.F90.

◆ saut

logical saut

Definition at line 102 of file parameters.F90.

◆ sc

integer sc

Definition at line 136 of file parameters.F90.

◆ sdate

character (len=15) sdate

Definition at line 334 of file parameters.F90.

◆ shell_vol

double precision, dimension(:), allocatable shell_vol

Definition at line 467 of file parameters.F90.

◆ shnum

integer shnum

Definition at line 141 of file parameters.F90.

◆ sigma_liss

double precision sigma_liss

Definition at line 423 of file parameters.F90.

◆ sij

double precision, dimension(:,:,:), allocatable sij

Definition at line 563 of file parameters.F90.

◆ sik

double precision, dimension(:), allocatable sik

Definition at line 483 of file parameters.F90.

◆ sinus_fact_rmax

double precision sinus_fact_rmax

Definition at line 422 of file parameters.F90.

◆ sinus_phi

double precision sinus_phi

Definition at line 417 of file parameters.F90.

◆ sknum

integer sknum

Definition at line 141 of file parameters.F90.

◆ sna

integer, dimension(:,:,:), allocatable sna

Definition at line 305 of file parameters.F90.

◆ spij

double precision, dimension(:,:,:), allocatable spij

Definition at line 563 of file parameters.F90.

◆ spind

character (len=16) spind

Definition at line 347 of file parameters.F90.

◆ spirr

integer spirr

Definition at line 134 of file parameters.F90.

◆ spna

integer, dimension(:), allocatable spna

Definition at line 221 of file parameters.F90.

◆ sqnum

integer sqnum

Definition at line 141 of file parameters.F90.

◆ sringord

integer, dimension(:,:,:,:), allocatable, target sringord

Definition at line 325 of file parameters.F90.

◆ sringsaved

integer, dimension(:,:,:), allocatable, target sringsaved

Definition at line 310 of file parameters.F90.

◆ ss_ij

double precision, dimension(:,:,:), allocatable ss_ij

Definition at line 564 of file parameters.F90.

◆ ssaut

logical ssaut

Definition at line 102 of file parameters.F90.

◆ statbd

integer, dimension(:,:,:), allocatable statbd

Definition at line 298 of file parameters.F90.

◆ stime

character (len=15) stime

Definition at line 334 of file parameters.F90.

◆ stpna

integer, dimension(:,:,:), allocatable stpna

Definition at line 304 of file parameters.F90.

◆ sum_index

integer sum_index

Definition at line 130 of file parameters.F90.

◆ szone

character (len=15) szone

Definition at line 334 of file parameters.F90.

◆ t

integer t =0

Definition at line 120 of file parameters.F90.

◆ tab_of_type

character (len=2), dimension(:), allocatable tab_of_type

Definition at line 358 of file parameters.F90.

◆ taillc

integer taillc

Definition at line 152 of file parameters.F90.

◆ tailld

integer tailld

Definition at line 150 of file parameters.F90.

◆ taille

integer taille

Definition at line 151 of file parameters.F90.

◆ taillh

integer taillh

Definition at line 151 of file parameters.F90.

◆ taillr

integer taillr

Definition at line 150 of file parameters.F90.

◆ taillt

integer taillt

Definition at line 151 of file parameters.F90.

◆ tbr

logical tbr =.false.

Definition at line 108 of file parameters.F90.

◆ tda

integer, dimension(:,:), allocatable tda

Definition at line 255 of file parameters.F90.

◆ tdfft

double precision, dimension(:), allocatable tdfft

Definition at line 487 of file parameters.F90.

◆ tdsa

integer, dimension(:,:,:), allocatable tdsa

Definition at line 290 of file parameters.F90.

◆ tdtabl

double precision, dimension(:), allocatable tdtabl

Definition at line 457 of file parameters.F90.

◆ testpix

type (pixel), dimension(:), allocatable testpix

Definition at line 652 of file parameters.F90.

◆ teta

double precision teta

Definition at line 404 of file parameters.F90.

◆ tetra

integer, dimension(:,:), allocatable tetra

Definition at line 236 of file parameters.F90.

◆ the_box

type (lattice), dimension(:), allocatable, target the_box

Definition at line 667 of file parameters.F90.

◆ thepix

type (pixel), dimension(:), allocatable thepix

Definition at line 652 of file parameters.F90.

◆ tigl

integer, dimension(:), allocatable tigl

Definition at line 210 of file parameters.F90.

◆ tiida

integer, dimension(:,:), allocatable tiida

Definition at line 240 of file parameters.F90.

◆ time_tot

double precision time_tot

Definition at line 400 of file parameters.F90.

◆ tisp

integer, dimension(:,:), allocatable tisp

Definition at line 241 of file parameters.F90.

◆ tl

character (len=2), dimension(:), allocatable tl

Definition at line 357 of file parameters.F90.

◆ tlt

integer tlt

Definition at line 153 of file parameters.F90.

◆ tmbs

integer tmbs

Definition at line 177 of file parameters.F90.

◆ togl

integer, dimension(:), allocatable togl

Definition at line 210 of file parameters.F90.

◆ tomo

logical tomo =.false.

Definition at line 74 of file parameters.F90.

◆ tot_geomsa

integer, dimension(:,:), allocatable tot_geomsa

Definition at line 235 of file parameters.F90.

◆ tot_gsa

integer, dimension(:), allocatable tot_gsa

Definition at line 207 of file parameters.F90.

◆ total_density

double precision total_density

Definition at line 408 of file parameters.F90.

◆ totpstep

double precision, dimension(:), allocatable totpstep

Definition at line 496 of file parameters.F90.

◆ trn

double precision, dimension(:), allocatable trn

Definition at line 464 of file parameters.F90.

◆ trx

double precision, dimension(:), allocatable trx

Definition at line 466 of file parameters.F90.

◆ tstat

double precision tstat

Definition at line 400 of file parameters.F90.

◆ tsub

integer tsub

Definition at line 123 of file parameters.F90.

◆ u

integer u =0

Definition at line 120 of file parameters.F90.

◆ v

integer v =0

Definition at line 120 of file parameters.F90.

◆ valid

integer, dimension(:), allocatable valid

Definition at line 222 of file parameters.F90.

◆ var

double precision, dimension(3) var

Definition at line 433 of file parameters.F90.

◆ vij

double precision vij

Definition at line 410 of file parameters.F90.

◆ voisj

integer, dimension(:,:,:), allocatable voisj

Definition at line 294 of file parameters.F90.

◆ vpat

integer, dimension(:,:), allocatable vpat

Definition at line 261 of file parameters.F90.

◆ vref

integer, dimension(:,:), allocatable vref

Definition at line 270 of file parameters.F90.

◆ w

double precision w =0.0d0

Definition at line 395 of file parameters.F90.

◆ x

double precision x =0.0d0

Definition at line 395 of file parameters.F90.

◆ xggrtot

double precision, dimension(:), allocatable xggrtot

Definition at line 465 of file parameters.F90.

◆ xgrtot

double precision, dimension(:), allocatable xgrtot

Definition at line 465 of file parameters.F90.

◆ xi

double precision, dimension(:), allocatable xi

Definition at line 440 of file parameters.F90.

◆ xs

double precision, dimension(:), allocatable xs

Definition at line 474 of file parameters.F90.

◆ xscattl

double precision, dimension(:), allocatable xscattl

Definition at line 473 of file parameters.F90.

◆ y

double precision y =0.0d0

Definition at line 395 of file parameters.F90.

◆ z

double precision z =0.0d0

Definition at line 395 of file parameters.F90.