Common Block NEWOLD
Specification
COMMON /NEWOLD/SHIFT,XOLD,XNEW,ESD,IFAM,IGEN,ISPC,NEWIN,KPACK,LKH,
&SHESD,ISHFT,AVSHFT,AMAXSH
Description
-
Shift information for one parameter after a least squares cycle
SHIFT shift, XOLD old value, XNEW new value ESD standard deviation
IFAM, IGEN, ISPC, family,genus and species of parameter
NEWIN fortran unit number of "new" crystal data file
KPACK packed parameter specification
LKH fortran unit number for hkl output
SHESD ratio SHIFT/ESD
ISHFT number of shifts dealt with so far in this cycle
AVSHFT the sum of their SHIFT/ESD so far
AMAXSH the maximum SHIFT/ESD so far
Declared by
-
ADJUST to use
SHIFT XOLD XNEW IGEN ISPC KPACK
APSHDS to use
SHIFT XOLD XNEW ESD IGEN ISPC KPACK SHESD
APSHFW to use
SHIFT XOLD XNEW ESD KPACK
APSHSF to use
SHIFT XOLD XNEW ESD IGEN ISPC KPACK SHESD
APSHT2 to use
SHIFT XOLD XNEW ESD IGEN ISPC KPACK SHESD
BATCH to use
NEWIN
CELNEW to use
NEWIN
DOMAG to use
XNEW IGEN ISPC NEWIN
DOMAG1 to use
DOMAG2 to use
XNEW IGEN ISPC NEWIN
DOMPL2 to use
SHIFT XOLD XNEW ESD IGEN ISPC NEWIN SHESD
DOTWN1 to use
DOTWN2 to use
IGEN ISPC NEWIN
EXTINC to use
NEWIN
F2NEW to use
NEWIN
F2SHFT to use
SHIFT ESD IGEN ISPC
FETSHF to use
SHESD ISHFT AVSHFT AMAXSH
GEOMCO to use
NEWIN
INITIL to use
NEWIN LKH
JMPOL to use
NEWIN
LLSCAL to use
ISPC NEWIN
LLTFAC to use
IGEN ISPC NEWIN
NEWCD to use
NEWIN
NWINDS to use
NEWIN
NWINFW to use
NEWIN
NWINSF to use
NEWIN
NWINT2 to use
NEWIN
OTPUTI to use
NEWIN
PARSSF to use
IGEN ISPC
PRMBLK to use
SHIFT XOLD XNEW ESD IGEN ISPC SHESD
RDFV to use
IGEN ISPC
SHFESD to use
SHIFT ESD
VARSSF to use
IGEN ISPC KPACK
CHILSQ to use
AMAXSH
MAGLSQ to use
AMAXSH
MMPLSQ to use
AMAXSH
DOTHER to use
MPLSQ to use
AMAXSH
PALSQ to use
AMAXSH
SFLSQ to use
AMAXSH
SFTLSQ to use
AMAXSH
Common Block NSYM
Specification
COMMON /NSYM/NOP,NCENT,NOPC,NLAT,NGEN,CENTRC,KOM13
LOGICAL CENTRC
Description
-
NOP number of symmetry operators
NCENT 1 if there is a centre of symmetry, 0 otherwise
NOPC 2 if there is a centre of symmetry, 1 otherwis
NLAT Number of non-primitive lattice translations
NGEN number of generating elements in the group
CENTRC true if centro-symmetric
Declared by
-
ADDELM to use
NOPC
ASUNIT to use
NOPC
ATMPLO to use
NLAT
ATMPLT to use
ATOGEN to use
NCENT NOPC NLAT
ATOMS to use
NCENT NOPC NLAT
ATOPOS to use
NOP NOPC NLAT CENTRC
BNDLST to use
NCENT NOPC NLAT
DOCHI1 to use
NOPC
DOMAG to use
NOPC
DOMAG1 to use
NOPC
DOMAG2 to use
NOPC
ERRMAP to use
NOP NOPC
FACGRP to use
NOPC
FCALC to use
NOPC CENTRC
FCHALC to use
NOPC CENTRC
FMCALC to use
NOPC CENTRC
FMMPCA to use
NOPC CENTRC
FMPCAL to use
NOPC CENTRC
FOUR1D to use
NOPC
FOUR1Z to use
NOPC
FOURGP to use
NOPC
GENELM to use
NOP NOPC NGEN
GENGRP to use
NOPC
ISPABS to use
NCENT NOPC
KSTARS to use
NOPC
LATABS to use
NLAT
LFCALC to use
NOPC CENTRC
LMCALC to use
NOPC CENTRC
LMMPCA to use
NOPC CENTRC
LMPCAL to use
NOPC CENTRC
MAGCON to use
NOPC CENTRC
MAGSYM to use
NOPC CENTRC
MAKGRP to use
NOPC
MPCON to use
NOPC
MUCALC to use
NOPC
OPMSYM to use
NOPC CENTRC
OPSYM to use
NOPC NLAT CENTRC
POLUNI to use
NOP NOPC
PROPAG to use
NOPC
PROPER to use
NOPC
PSICON to use
NOP NOPC
RDATOM to use
NOPC NLAT CENTRC
ROTOSM to use
NOPC
SATFND to use
NOPC
SATGEN to use
NOP NOPC
SUBSYM to use
NOP NCENT NOPC NGEN CENTRC
SYMBAK to use
NOP NCENT NOPC CENTRC
SYMCEN to use
NOP NCENT NOPC CENTRC
SYMEQU to use
NOP
SYMFRI to use
CENTRC
SYMGEN to use
NOP NOPC NGEN CENTRC
SYMOP to use
NOP NLAT
SYMREF to use
NOP NCENT NOPC
SYMTID to use
NOP NOPC NGEN CENTRC
SYMUNI to use
NOP NOPC CENTRC
TRYUNI to use
NOPC
UNUSYM to use
NOPC
USYM to use
NOPC
XROOT to use
NCENT NOPC NLAT
ADDFC to use
CENTRC
ARRINC to use
NOPC
ARRNGE to use
NOPC
LCHALC to use
NOPC CENTRC
GENREF to use
NOP
GETMSF to use
NOPC
GETSFZ to use
NOPC
INCMSF to use
NOPC
MAG3D to use
NCENT NOPC NLAT
MG3DGL to use
NCENT NOPC NLAT
MPLSQ to use
CENTRC
MVENTR to use
NCENT NOPC NLAT
PALSQ to use
CENTRC
SFLSQ to use
CENTRC
SFTLSQ to use
CENTRC
Common Block NTITL
Specification
COMMON /NTITL/NTITLE,KOM14
Description
-
NTITLE Number of character i the title
Declared by
-
INPUTN to use
NTITLE
MAPTIT to use
NTITLE
STPLOT to use
NTITLE
MAG3D to use
NTITLE
POSOUT to use
NTITLE
P. Jane Brown
e-mail: brown@ill.fr
Institut Laue Langevin,
Grenoble, FRANCE