qmcpack/tests/molecules/H2O_dimer_sep_pp/qmc_ref/compare.plt

14 lines
402 B
Gnuplot

#/usr/bin/gnuplot
reset
set term png size 640,480
set output "compare.png"
set key right center
set xlabel "Number of water molecules"
set ylabel "Energy per molecule"
p 'dmc_no.dat' u 1:($2/$1):($4/$1) w errorlines t "LA", \
'dmc_v0.dat' u 1:($2/$1):($4/$1) w errorlines t "TM0", \
'dmc_v1.dat' u 1:($2/$1):($4/$1) w errorlines t "TM1", \
'dmc_v3.dat' u 1:($2/$1):($4/$1) w errorlines t "TM3"