ELF>,@@AWEAVIAUIATIUHSH(EtIcH(LHHj1`mHA$H|$@AEHD$HD$PLl$`D$@D$DHt$H|$@H|$@D$= EAEtcIc׾H$H CORE CI~$AF NGE IHORRECTIOH$IFHN MESH O IFHUT OF RAIFH([]A\A]A^A_fDHPjHD$IfDT$ pf(\XfT^f.HH;\$0A$H|$@AEHD$HD$PLl$`D$@D$DHt$ H|$@H|$@HH|$@E@JL$ pf(AH error wI~(H(IHhile rea IFHding atoIFHmic coreIFH pseudo IF @EAEIcH&:H(L[]A\A]A^A_@E@MD$= E@[HcЃ*HոmL$^mL$H|$@HD$HD$P^D$@D$DD$0D$H|$@ Ht$0H|$@H|$@HmHUhD$H9EPf(HfHf@fYffH9uEDH core coI~&AF matcIHr. radiaH&IFHl mesh d IFHoes not IFh fAF$ HMXHmH9;1YHH`muAWAVIAUEATIUHSHHEtIcH#0LfEH|$HD$D$ _D$C,D$HsH|$HsH|$H|$EH|$HD$D$ `D$D$HCH|$HH$Hs$H|$Hs(H|$C(2L{,Hl0II9tH|$LD$tH|$k(k,k0k4k8vlEAtHIcվHHLNL out I|$HI$Hof range ID$fDH[]A\A]A^A_fDDC$AEAtIcվHHLLOC outI|$AD$eI$H of rangHID$ @fDH error wdoI|$#I$Hhile reafAL$ ID$Hding heaAD$" ID$Hder pseuH#ID$ y@St*H4$DD$ DD$ wUS0;S,tC49t 9C8C,A9t@C0A9t,tC4A9t`C8A9QEAAIcH*HL[]A\A]A^A_EAIcվH5vH NONLOCAI|$5AD$0ORDEI$HL COMPONAD$4RID$HENTS MUSH5ID$HT BE GIV ID$HEN IN ASID$ HCENDING ID$(qifL $Ht$AA 4E%IcH4w[Ht$L H LLOC.EQI|$AD$OCALI$H.L NON LHID$!! fAD$HD$I|$4H4 I$HD$ID$HD$ ID$HD$(ID$HD$0ID$ HD$8ID$(D$@AD$0eDSHHWLHHEHW(H+W HHH9NHc˃HH)AA^*H|$ HD$(D$0D$ D$$^D$D$H|$ Ht$H|$ H|$ D$H[fff.AWAVEAUATIUHSHHEH|$tIcHHLȴE1K|=1`mI`mIuߋs(ǃHǃHǃHǃHǃǃǃǃǃuqHĈ[]A\A]A^A_H error wwfEmic HEHhile reaf}HEH}Hding atoHEE H HD$H$HDŽ$DŽ$HDŽ$DŽ$DŽ$$Ht$PH$PH$$uA$@Ht$PH|$HDŽ$DŽ$D$PD$TAD$( I$xMĀfDHL9HHD$PtHD$`gHDŽ$DŽ$4D$PM$D$TAIt$ HHHHD$XD$`hHDŽ$DŽ$!D$PD$THHHD$XD$`iHDŽ$DŽ$ D$PD$TI$HHHD$I$HI$HI$HHHHD$XD$`nHDŽ$DŽ$(D$PD$THAD$ HL$LLL,fDHHD$XD$`qHDŽ$DŽ$D$PD$THHHuHHHHHHL9vIII ?rH\$PMl$D$`EHDŽ$DŽ$%HD$PD$TLHHHHD$XD$`FHDŽ$DŽ$(D$PD$TIt$$H0AWAVAUIATUHSHxH$&HT$0HDŽ$&DŽ$'HDŽ$8'$&DŽ$@'DŽ$&H$@H$&PH$&AEH$&HDŽ$&DŽ$'HDŽ$8'DŽ$@'DŽ$&$&Ht$pH$&H$H$&H$H$&H$H$&H$H$&Ht$PH$&H$H$&Ht$`H$&H$H$&H$H$&PH$&$D$S$D$@DuEAEH$&HDŽ$&DŽ$'HDŽ$8'DŽ$@'DŽ$&$&H$H$&H$H$&H$H$&H$H$&H$H$&H$&$= D$,W$D$D6Dd$EyD$H$L$&H$pqAHl$8HL$D$D$,HHD$ @AEHHDŽ$xqDŽ$qHDŽ$qDŽ$qDŽ$pq$tqHt$PHH$HHAEHHDŽ$xqDŽ$qHDŽ$qDŽ$qDŽ$pq$tqD\$,E~:HD$ MJ,0fII9tLH$pqtHAI`mD;d$Hl$8\$@; DL$DEH$L$H$H$L$pqHl$HHD$H$ HL$INjD$DIFHD$ D$,HHD$8f.AEH$0HDŽ$8DŽ$@HDŽ$xLDŽ$DŽ$0$4Ht$H$0PH$0H޺H$0AEH$0HDŽ$8DŽ$@HDŽ$xDŽ$ DŽ$0$4Ht$H$0H$0LH$0AEH$0HDŽ$8DŽ$@HDŽ$xDŽ$DŽ$0$4DD$,HD$8EJ /HH9tH$0H$0tH$0II`mLHD$L;t$ tgID}EHD$0Hx[]A\A]A^A_fDHD$0HD$0HD$0Hl$HDl$$D$,LmHEH`m1ALE1Dm1HIIM9~L<$H|$8~QHD$8Hl$0ILt$PL<$AMHHIK|>1HIIM9~L<$XDt$DIoAHE1LHHA9JADL$`HMcLH EEQ~D҃H H<HIiЬ Hi HLHHH H1XDYhGAHH9uHHAAHDŽ$HTYY"A1AfWD%H-H Df(YALYLXADYDHH9YYYXf(YXu$LHH^H$$HDŽ$DŽ$ }DŽ$HDŽ$LH$HHHH$HtHt$`H$H$H$H$$II9Hc51HIH1HOH=ZHHEHHHHc-HHHHHcHH~H1H=~eH5HH$PqL1AL1hGYYXHH`muHH`m9uHc1҅LcLILHHIIԅ7/HHH9H=HHEHHHcHc5HHHHL%HH HH51HH HHHHHHH HSHH6tHHHHSH5H$PqH$&LHH41hGDHH`muH`mLH9uH$HDŽ$DŽ$ HDŽ$XDŽ$`DŽ$DŽ$H$&H$1MHĨL[]A\A]A^A_II91II9~#1 1'`m$$HH,fWX1HD$`aE14HHyHĨ[]A\A]A^A_H$qH9H H1DYTHH=`muH]SI?5`m$HH HHHHH$1111E11;1111111111111111111D?fWYGY~z1%H-H ff(YLYLXDYDHH9YYYXf(YXuf error while reading atomic core pseudo CORE CORRECTION MESH OUT OF RANGE core cor. radial mesh does not match amesh (dx) = error while reading header pseudo LNL out of rangeLLOC out of rangeNUMERICtmix not implemented for pseudo NONLOCAL COMPONENTS MUST BE GIVEN IN ASCENDING ORDER LLOC.EQ.L NON LOCAL!! error while reading atomic wf (A80) nchan = (wf) NCHAN NOT PROGRAMMED WAVMESH OUT OF RANGE radial meshes do not match error while reading atomic numeric pseudo nchan (pp) = NPOTMESH OUT OF RANGE ap rw too small ( 3X,'Type is ',A10,' and NONLOCAL. ')( 3X,'Mixed reference potential:')( 3X,' L :',3(9X,i1))( 3X,' Weight:',3(2X,F8.5))( 3X,'Local component is ..... : ',I3)( 3X,'Non local components are : ',4I3)( 3X,'Type is ',A10,' and LOCAL. ')( 3X,'Pseudo charge : ',F8.3,', pseudo radius : ',F8.3)ANALYTIC(/, 3X,'Pseudopotentials Grid : Channels = ',I2, ', Mesh = ',I5,/,30X,'dx = ',F16.14)( 3X,'point radius pseudopotential')(I8,F15.10,5F10.6)(/, 3X,'Gaussians used : ',I2,'. Parameters are : ')( 3X,'C (core), Alfa(core) : ')(4(3X,F8.4))( 3X,'Hsc radii and coeff. A and B :')(3X,F8.4,2(3X,F15.7))(/, 3X,'Atomic wavefunction Grid : Channels = ',I2, ', Mesh = ',I5,/,30X,'dx = ',F16.14)( 3X,'Channels occupation number : ',5F10.4)( 3X,'point radius wavefunction')(/, 3X,'Core correction Grid : Mesh = ',I5, ', dx = ',F16.14)( 3X,'point radius rho core')(a)(a4,f5.1,3i2,a2,l1,a2,i2,a)(f8.2,f8.4,f10.6,2i6)(A16,i1)(4e16.8)(A16,a2)(i5,f6.2) error while reading atomic analytic pseudo IGAU NOT PROGRAMMED OLDGIANNOZ Pseudopotential type not implemented readpseudo fpmd_pseudo("Generated using unknown code")("Author: unknown Generation date: as well")Pseudopotential successfully converted Dfpmd2upf.f90psfilenwfswflwfocpsdiexchicorrigcxigcczpelsocepseulchinnsrcutrcutuselswocwlchiwrabrrho_atcvloc0ikk2lllbetarqfuncdionqqqrho_atchiInteger overflow when calculating the amount of memory to allocateAttempting to allocate already allocated variable '%s'At line 812 of file fpmd2upf.f90Allocation would exceed memory limitAt line 813 of file fpmd2upf.f90At line 814 of file fpmd2upf.f90At line 839 of file fpmd2upf.f90At line 846 of file fpmd2upf.f90At line 847 of file fpmd2upf.f90At line 854 of file fpmd2upf.f90At line 857 of file fpmd2upf.f90At line 863 of file fpmd2upf.f90At line 873 of file fpmd2upf.f90At line 874 of file fpmd2upf.f90At line 875 of file fpmd2upf.f90At line 876 of file fpmd2upf.f90At line 899 of file fpmd2upf.f90At line 905 of file fpmd2upf.f90H1HV@h㈵>??@@@@7^*fR??$@UUUUUU?@0@??S 6#6|888818 * aH m1 T8 I n1 ra* rb**"1ap6I1Ij11{*{|^IP{oLLU{^N"U{T Q=wNGU{T{Q8NU{NU~T Q $ &NUsT0Q `mNU{NU{T{Q4O U{O7U~$T Q  $ &$NPU{AOuU{T{Q8AOU{TsQ8OU{OU~(T Q  $ &( NUQOU~&T Q  $ &&PkP1apP6PIP1IlW1NU|T Q} $ &NU{ZO U{TsQ4ZO0U{TsQ4OIU{NbU{sOU{TwQDNU{Ts$Q4NU{Ts(Q4NU{TQ4O U{O8U|T Q } $ &@OdU|T Q } $ &AOU|#T Q } $ &#OUDTwQ7R  NUQOU|5T Q } $ &5OEU4T{Q R XDYwNpU|T{Q} $ &OU|T Q } $ &FOU|4T Q } $ &4!Ja 1ap6J1IJ{j1m11z"nf1z*{#1NUvT Q~ $ &NU }" `mT0Q `mO UvT Q ~ $ &ON9 U{sO_ U{T{QPOx U{O UzT{Q0RPX0P UPT{N U{N U{TzQ4N) U{TQ4AOO U{TzQ8Oh U{O UvT Q ~ $ &FN U{N U{TzQ4N U{TQ4O 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