ELF4(UWVS1ہDžDžtDž|HDƉ$DžDžDž(DžLHDƉ$ ɉ0IDƉ$,Hȉlj$ɉHDƉ$Dž ЉxtHDƉ$=IDƉ$IDƉ$Dž8pHDƉ$DžPHȉljɉȋ HÉHDƉ$ډЉ+xI…HHHDƉ$IDƉ$HDƉމ$  =II߅ۉz91ҁЅɉЉ;3DÉ$PhDžX"Dž`ЉTDž\dDžlpIЉN΁pDˉ $d;IЉNƁ$DÉ$ T Dž= = 1څIЉNˁ  ɸE$S Dž!DžDžDž DžDžDžDž-Dž$DžDž$DžDž.Dž$Dž Dž$DžDž/Dž4$Dž%Dž$DžDž0DžY$DžDž$v,D$ D$ D$hD$l$4x ÉƋ81x$H9lj5<" A‹‰91?Nj   u EЉ$; Dž@ݝݝݝݝ ݝ(ݝ0ݝx8ݝp|@AݝhGG݅ݝH݅ݝP݅ݝX$݅݅Hɉ`݅݅P݅݅X$݅H܍x݅P܍p݅X܍h$Ћ`;@= Džމt&;tt9XDž`pDDDDƋ\))ߋDË,HPt&`XDžD8\ gcutm for gtr=wrong gtrerror in factorization(/,21X,'K-POINTS STRINGS USED IN CALCULATIONS')(21X,37('~'),/)(7X,'G-vector along string (2 pi/a):',3F9.5)(7X,'Modulus of the vector (1/bohr):',F9.5)(7X,'Number of k-points per string:',I4)(7X,'Number of different strings :',I4)(2/,31X,'IONIC POLARIZATION')(31X,18('~'),/)(8X,'Note: (mod 1) means that the phases (angles ranging from' /,8X,'-pi to pi) have been mapped to the interval [-1/2,+1/2) by', /,8X,'dividing by 2*pi; (mod 2) refers to the interval [-1,+1)', /)(2X,76('='))(4X,'Ion',4X,'Species',4X,'Charge',14X, 'Position',16X,'Phase')(2X,76('-'))(47X,'IONIC PHASE: ',F9.5,' (mod ',I1,')')(2/,28X,'ELECTRONIC POLARIZATION')(28X,23('~'),/)(3X,'Spin',4X,'String',5X,'Weight',6X, 'First k-point in string',9X,'Phase')(3X,I3,8X,A2,F12.3,5X,3F8.4,F12.5,' (mod ',I1,')')(3X,' up ',3X,I5,F14.6,4X,3(F8.4),F12.5,' (mod ',I1,')')(3X,'down',3X,I5,F14.6,4X,3(F8.4),F12.5,' (mod ',I1,')')(3X,'down',3X,I4,F15.6,4X,3(F8.4),F12.5,' (mod ',I1,')')(42X,'Average phase : ',F9.5,' (mod ',I1,')')(40X,'Average phase (up): ',F9.5,' (mod ',I1,')')(38X,'Average phase (down): ',F9.5,' (mod ',I1,')')(42X,'ELECTRONIC PHASE: ',F9.5,' (mod ',I1,')')(2/,31X,'SUMMARY OF PHASES')(31X,17('~'),/)(26X,'Ionic Phase:',F9.5,' (mod ',I1,')')(21X,'Electronic Phase:',F9.5,' (mod ',I1,')')(26X,'TOTAL PHASE:',F9.5,' (mod ',I1,')')(2/,29X,'VALUES OF POLARIZATION')(29X,22('~'),/)( 8X,'The calculation of phases done along the direction of vector ',I1, /,8X,'of the reciprocal lattice gives the following contribution to', /,8X,'the polarization vector (in different units, and being Omega', /,8X,'the volume of the unit cell):')(/,11X,'P = ',F11.7,' (mod ',F11.7,') (e/Omega).bohr')(/,11X,'P = ',F11.7,' (mod ',F11.7,') e/bohr^2')(/,11X,'P = ',F11.7,' (mod ',F11.7,') C/m^2')(/,8X,'The polarization direction is: ( ', F7.5,' , ',F7.5,' , ',F7.5,' )')(/,/,15X,50('=')/,/)?ư>-DT!@݇L@?hU$a rk$ncH-x-|--2- -0.&### 8## #80.### @## #@z0.h### @## #@#(#,#$@ Dnst-nspnswnr1-4nr2-8nr3-<P -@ -D -Hnpl-Lnnp-Pnnr-TnglXnwl!pnppEippiiss H   -0 -4 -8 -< !A@ 0.-### 4 0.-### 4 0.-!### 4 0.-E### 4 0.-i### 4 0.-### 4 0.-### 4 0.-### 4 0.-### 4 0.-### 4 0.-A### 4m at( Ad Ahl &l d  <( Ad Ah\ Hl & &- ( Ad AhAl,&pAx&|A  & ( Ad Ahl Al ?p CAp -t 9x ^( Ad Ahionl &   ( Ad AhAl\&p Ax| | 2( Ad Ahm^l A -  4( Ad Ah\ l l y   w-, -0 0.###   0.###    P   HI a x  oc  ) &, -4 -8 - &< Tr D0.&### 80.& ### 8## #8#(#,#$80.&a ### 8## #8#(#,#$80.& ### 8## #8#(#,#$80.& ### 8## #80.& ### 80.&) ### 80.&r ### 8## #8#(#,#$8 1 u-r r21 rabU 4sqry Lrm1 drm2 |rm3 +&&&dx&0.&1 ### 80.&U ### 80.&y ### 80.& ### 80.& ### 80.& ### 80.& ### 8 |x  P psd@typBrelV A\ kA` f Ad (Ahdftlzp& & & '&nv t - -vnl :- ,-  2- lll !(elsXL |d | 9oc   @ 0 ! 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