set terminal windows enhanced set xrange[8:15] set key box left top set xlabel "Atomic volume ({\305}^3)" set ylabel "Energy (Ry)" plot 'C:\cygwin\home\Administrator\kkr\cpa2002v009c\project\stableFe\analysis\Energy.dat' u 1:2 title "{/Symbol a}-Fe" rep 'C:\cygwin\home\Administrator\kkr\cpa2002v009c\project\stableFe\analysis\Energy.dat' u 1:4 title "{/Symbol g}-Fe" rep 'C:\cygwin\home\Administrator\kkr\cpa2002v009c\project\stableFe\analysis\Energy.dat' u 1:3 title "{/Symbol d}-Fe" ba = 0.0869502 v0a = 11.092 e0a = -2522.82 dbdpa = 4.53622 alpha(x) = ba * x / (dbdpa * (dbdpa - 1)) * (dbdpa * (1 - v0a / x) + (v0a / x) ** dbdpa - 1) + e0a fit alpha(x) 'C:\cygwin\home\Administrator\kkr\cpa2002v009c\project\stableFe\analysis\Energy.dat' using 1:2 via ba,v0a,e0a,dbdpa rep alpha(x) lc rgb "red" notitle bb = 0.1 v0b = 11 e0b = -2522.8 dbdpb = 4 beta(x) = bb * x / (dbdpb * (dbdpb - 1)) * (dbdpb * (1 - v0b / x) + (v0b / x) ** dbdpb - 1) + e0b fit beta(x) 'C:\cygwin\home\Administrator\kkr\cpa2002v009c\project\stableFe\analysis\Energy.dat' using 1:4 via bb,v0b,e0b,dbdpb rep beta(x) lc rgb "green" notitle bc = 0.1 v0c = 11 e0c = -2522.8 dbdpc = 4 delta(x) = bc * x / (dbdpc * (dbdpc - 1)) * (dbdpc * (1 - v0c / x) + (v0c / x) ** dbdpc - 1) + e0c fit delta(x) 'C:\cygwin\home\Administrator\kkr\cpa2002v009c\project\stableFe\analysis\Energy.dat' using 1:3 via bc,v0c,e0c,dbdpc rep delta(x) lc rgb "blue" notitle