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chrisfen |
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# ACE/gr parameter file |
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# |
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@version 40102 |
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@page layout free |
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@ps linewidth begin 1 |
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@ps linewidth increment 2 |
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@hardcopy device 1 |
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@page 5 |
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@page inout 5 |
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@link page off |
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@default linestyle 1 |
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@default linewidth 1 |
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@default color 1 |
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@default char size 1.000000 |
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@default font 4 |
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@default font source 0 |
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@default symbol size 1.000000 |
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@timestamp off |
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@timestamp 0.03, 0.03 |
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@timestamp linewidth 1 |
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@timestamp color 1 |
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@timestamp rot 0 |
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@timestamp font 4 |
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@timestamp char size 1.000000 |
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@timestamp def "Tue May 13 11:01:01 2003" |
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@with g0 |
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@g0 on |
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@g0 label off |
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@g0 hidden false |
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@g0 type xy |
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@g0 autoscale type AUTO |
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@g0 fixedpoint off |
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@g0 fixedpoint type 0 |
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@g0 fixedpoint xy 0.000000, 0.000000 |
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@g0 fixedpoint format general general |
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@g0 fixedpoint prec 6, 6 |
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@ world xmin 225 |
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@ world xmax 350 |
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@ world ymin 0.825 |
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@ world ymax 1.075 |
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@ stack world 0, 0, 0, 0 tick 0, 0, 0, 0 |
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@ view xmin 0.150000 |
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@ view xmax 0.850000 |
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@ view ymin 0.150000 |
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@ view ymax 0.850000 |
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@ title "" |
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@ title font 4 |
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@ title size 1.500000 |
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@ title color 1 |
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@ title linewidth 1 |
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@ subtitle "" |
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@ subtitle font 4 |
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@ subtitle size 1.000000 |
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@ subtitle color 1 |
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@ subtitle linewidth 1 |
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@ s0 symbol 3 |
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@ s0 symbol size 1.000000 |
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@ s0 symbol fill 2 |
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@ s0 symbol color 1 |
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@ s0 symbol linewidth 2 |
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@ s0 symbol linestyle 1 |
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@ s0 symbol center false |
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@ s0 symbol char 0 |
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@ s0 skip 0 |
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@ s0 linestyle 5 |
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@ s0 linewidth 2 |
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@ s0 color 1 |
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@ s0 fill 0 |
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@ s0 fill with color |
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@ s0 fill color 1 |
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@ s0 fill pattern 0 |
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@ s0 errorbar type BOTH |
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@ s0 errorbar length 1.000000 |
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@ s0 errorbar linewidth 1 |
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@ s0 errorbar linestyle 1 |
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@ s0 errorbar riser on |
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@ s0 errorbar riser linewidth 1 |
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@ s0 errorbar riser linestyle 1 |
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@ s0 xyz 0.000000, 0.000000 |
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@ s0 comment "tips.txt:1" |
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@ s1 symbol 5 |
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@ s1 symbol size 1.000000 |
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@ s1 symbol fill 2 |
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@ s1 symbol color 1 |
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@ s1 symbol linewidth 2 |
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@ s1 symbol linestyle 1 |
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@ s1 symbol center false |
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@ s1 symbol char 0 |
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@ s1 skip 0 |
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@ s1 linestyle 3 |
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@ s1 linewidth 2 |
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@ s1 color 1 |
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@ s1 fill 0 |
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@ s1 fill with color |
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@ s1 fill color 1 |
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@ s1 fill pattern 0 |
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@ s1 errorbar type BOTH |
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@ s1 errorbar length 1.000000 |
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@ s1 errorbar linewidth 1 |
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@ s1 errorbar linestyle 1 |
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@ s1 errorbar riser on |
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@ s1 errorbar riser linewidth 1 |
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@ s1 errorbar riser linestyle 1 |
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@ s1 xyz 0.000000, 0.000000 |
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@ s1 comment "tips.txt:2" |
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@ s2 symbol 4 |
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@ s2 symbol size 1.000000 |
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@ s2 symbol fill 2 |
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@ s2 symbol color 1 |
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@ s2 symbol linewidth 2 |
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@ s2 symbol linestyle 1 |
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@ s2 symbol center false |
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@ s2 symbol char 0 |
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@ s2 skip 0 |
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@ s2 linestyle 2 |
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@ s2 linewidth 2 |
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@ s2 color 1 |
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@ s2 fill 0 |
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@ s2 fill with color |
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@ s2 fill color 1 |
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@ s2 fill pattern 0 |
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@ s2 errorbar type BOTH |
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@ s2 errorbar length 1.000000 |
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@ s2 errorbar linewidth 1 |
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@ s2 errorbar linestyle 1 |
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@ s2 errorbar riser on |
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@ s2 errorbar riser linewidth 1 |
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@ s2 errorbar riser linestyle 1 |
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@ s2 xyz 0.000000, 0.000000 |
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@ s2 comment "/home/maul/gezelter/chrisfen/spceDense.txt" |
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@ s3 symbol 7 |
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@ s3 symbol size 1.000000 |
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@ s3 symbol fill 2 |
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@ s3 symbol color 1 |
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@ s3 symbol linewidth 2 |
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@ s3 symbol linestyle 1 |
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@ s3 symbol center false |
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@ s3 symbol char 0 |
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@ s3 skip 0 |
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@ s3 linestyle 4 |
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@ s3 linewidth 2 |
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@ s3 color 1 |
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@ s3 fill 0 |
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@ s3 fill with color |
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@ s3 fill color 1 |
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@ s3 fill pattern 0 |
147 |
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@ s3 errorbar type BOTH |
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@ s3 errorbar length 1.000000 |
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@ s3 errorbar linewidth 1 |
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@ s3 errorbar linestyle 1 |
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@ s3 errorbar riser on |
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@ s3 errorbar riser linewidth 1 |
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@ s3 errorbar riser linestyle 1 |
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@ s3 xyz 0.000000, 0.000000 |
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@ s3 comment "/home/maul/gezelter/chrisfen/noThrow.txt" |
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@ s5 symbol 2 |
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@ s5 symbol size 1.000000 |
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@ s5 symbol fill 2 |
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@ s5 symbol color 1 |
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@ s5 symbol linewidth 2 |
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@ s5 symbol linestyle 1 |
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@ s5 symbol center false |
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@ s5 symbol char 0 |
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@ s5 skip 0 |
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@ s5 linestyle 1 |
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@ s5 linewidth 2 |
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@ s5 color 1 |
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@ s5 fill 0 |
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@ s5 fill with color |
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@ s5 fill color 1 |
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@ s5 fill pattern 0 |
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@ s5 errorbar type BOTH |
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@ s5 errorbar length 1.000000 |
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@ s5 errorbar linewidth 1 |
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@ s5 errorbar linestyle 1 |
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@ s5 errorbar riser on |
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@ s5 errorbar riser linewidth 1 |
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@ s5 errorbar riser linestyle 1 |
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@ s5 xyz 0.000000, 0.000000 |
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@ s5 comment "/home/maul/gezelter/chrisfen/water.txt" |
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@ xaxis tick on |
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@ xaxis tick major 25 |
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@ xaxis tick minor 5 |
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@ xaxis tick offsetx 0.000000 |
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@ xaxis tick offsety 0.000000 |
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@ xaxis label "Temperature (K)" |
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@ xaxis label layout para |
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@ xaxis label place auto |
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@ xaxis label char size 1.000000 |
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@ xaxis label font 0 |
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@ xaxis label color 1 |
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@ xaxis label linewidth 1 |
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@ xaxis ticklabel on |
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@ xaxis ticklabel type auto |
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@ xaxis ticklabel prec 5 |
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@ xaxis ticklabel format general |
197 |
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@ xaxis ticklabel append "" |
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@ xaxis ticklabel prepend "" |
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@ xaxis ticklabel layout horizontal |
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@ xaxis ticklabel place on ticks |
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@ xaxis ticklabel skip 0 |
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@ xaxis ticklabel stagger 0 |
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@ xaxis ticklabel op bottom |
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@ xaxis ticklabel sign normal |
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@ xaxis ticklabel start type auto |
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@ xaxis ticklabel start 0.000000 |
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@ xaxis ticklabel stop type auto |
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@ xaxis ticklabel stop 0.000000 |
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@ xaxis ticklabel char size 1.000000 |
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@ xaxis ticklabel font 0 |
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@ xaxis ticklabel color 1 |
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@ xaxis ticklabel linewidth 1 |
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@ xaxis tick major on |
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@ xaxis tick minor on |
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@ xaxis tick default 6 |
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@ xaxis tick in |
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@ xaxis tick major color 1 |
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@ xaxis tick major linewidth 1 |
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@ xaxis tick major linestyle 1 |
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@ xaxis tick minor color 1 |
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@ xaxis tick minor linewidth 1 |
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@ xaxis tick minor linestyle 1 |
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@ xaxis tick log off |
224 |
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@ xaxis tick size 1.000000 |
225 |
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@ xaxis tick minor size 0.500000 |
226 |
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@ xaxis bar off |
227 |
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@ xaxis bar color 1 |
228 |
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@ xaxis bar linestyle 1 |
229 |
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@ xaxis bar linewidth 1 |
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@ xaxis tick major grid off |
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@ xaxis tick minor grid off |
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@ xaxis tick op both |
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@ xaxis tick type auto |
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@ xaxis tick spec 0 |
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@ yaxis tick on |
236 |
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@ yaxis tick major 0.05 |
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@ yaxis tick minor 0.025 |
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@ yaxis tick offsetx 0.000000 |
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@ yaxis tick offsety 0.000000 |
240 |
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@ yaxis label "Density (g/cm\S3\N) " |
241 |
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@ yaxis label layout para |
242 |
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@ yaxis label place auto |
243 |
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@ yaxis label char size 1.000000 |
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@ yaxis label font 0 |
245 |
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@ yaxis label color 1 |
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@ yaxis label linewidth 1 |
247 |
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@ yaxis ticklabel on |
248 |
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@ yaxis ticklabel type auto |
249 |
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@ yaxis ticklabel prec 5 |
250 |
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@ yaxis ticklabel format general |
251 |
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@ yaxis ticklabel append "" |
252 |
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@ yaxis ticklabel prepend "" |
253 |
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@ yaxis ticklabel layout horizontal |
254 |
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@ yaxis ticklabel place on ticks |
255 |
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@ yaxis ticklabel skip 0 |
256 |
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@ yaxis ticklabel stagger 0 |
257 |
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@ yaxis ticklabel op left |
258 |
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@ yaxis ticklabel sign normal |
259 |
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@ yaxis ticklabel start type auto |
260 |
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@ yaxis ticklabel start 0.000000 |
261 |
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@ yaxis ticklabel stop type auto |
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@ yaxis ticklabel stop 0.000000 |
263 |
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@ yaxis ticklabel char size 1.000000 |
264 |
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@ yaxis ticklabel font 0 |
265 |
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@ yaxis ticklabel color 1 |
266 |
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@ yaxis ticklabel linewidth 1 |
267 |
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@ yaxis tick major on |
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@ yaxis tick minor on |
269 |
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@ yaxis tick default 6 |
270 |
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@ yaxis tick in |
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@ yaxis tick major color 1 |
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@ yaxis tick major linewidth 1 |
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@ yaxis tick major linestyle 1 |
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@ yaxis tick minor color 1 |
275 |
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@ yaxis tick minor linewidth 1 |
276 |
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@ yaxis tick minor linestyle 1 |
277 |
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@ yaxis tick log off |
278 |
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@ yaxis tick size 1.000000 |
279 |
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@ yaxis tick minor size 0.500000 |
280 |
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@ yaxis bar off |
281 |
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@ yaxis bar color 1 |
282 |
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@ yaxis bar linestyle 1 |
283 |
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@ yaxis bar linewidth 1 |
284 |
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@ yaxis tick major grid off |
285 |
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@ yaxis tick minor grid off |
286 |
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@ yaxis tick op both |
287 |
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@ yaxis tick type auto |
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@ yaxis tick spec 0 |
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@ zeroxaxis tick on |
290 |
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@ zeroxaxis tick major 50 |
291 |
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@ zeroxaxis tick minor 25 |
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@ zeroxaxis tick offsetx 0.000000 |
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@ zeroxaxis tick offsety 0.000000 |
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@ zeroxaxis label "" |
295 |
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@ zeroxaxis label layout para |
296 |
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@ zeroxaxis label place auto |
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@ zeroxaxis label char size 1.000000 |
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@ zeroxaxis label font 4 |
299 |
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@ zeroxaxis label color 1 |
300 |
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@ zeroxaxis label linewidth 1 |
301 |
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@ zeroxaxis ticklabel off |
302 |
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@ zeroxaxis ticklabel type auto |
303 |
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@ zeroxaxis ticklabel prec 5 |
304 |
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@ zeroxaxis ticklabel format general |
305 |
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@ zeroxaxis ticklabel append "" |
306 |
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@ zeroxaxis ticklabel prepend "" |
307 |
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@ zeroxaxis ticklabel layout horizontal |
308 |
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@ zeroxaxis ticklabel place on ticks |
309 |
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@ zeroxaxis ticklabel skip 0 |
310 |
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@ zeroxaxis ticklabel stagger 0 |
311 |
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@ zeroxaxis ticklabel op bottom |
312 |
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@ zeroxaxis ticklabel sign normal |
313 |
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@ zeroxaxis ticklabel start type auto |
314 |
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@ zeroxaxis ticklabel start 0.000000 |
315 |
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@ zeroxaxis ticklabel stop type auto |
316 |
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@ zeroxaxis ticklabel stop 0.000000 |
317 |
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@ zeroxaxis ticklabel char size 1.000000 |
318 |
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@ zeroxaxis ticklabel font 4 |
319 |
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@ zeroxaxis ticklabel color 1 |
320 |
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@ zeroxaxis ticklabel linewidth 1 |
321 |
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@ zeroxaxis tick major off |
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@ zeroxaxis tick minor on |
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@ zeroxaxis tick default 6 |
324 |
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@ zeroxaxis tick in |
325 |
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@ zeroxaxis tick major color 1 |
326 |
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@ zeroxaxis tick major linewidth 1 |
327 |
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@ zeroxaxis tick major linestyle 1 |
328 |
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@ zeroxaxis tick minor color 1 |
329 |
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@ zeroxaxis tick minor linewidth 1 |
330 |
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@ zeroxaxis tick minor linestyle 1 |
331 |
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@ zeroxaxis tick log off |
332 |
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@ zeroxaxis tick size 1.000000 |
333 |
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@ zeroxaxis tick minor size 0.500000 |
334 |
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@ zeroxaxis bar off |
335 |
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@ zeroxaxis bar color 1 |
336 |
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@ zeroxaxis bar linestyle 1 |
337 |
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@ zeroxaxis bar linewidth 1 |
338 |
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@ zeroxaxis tick major grid off |
339 |
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@ zeroxaxis tick minor grid off |
340 |
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@ zeroxaxis tick op both |
341 |
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@ zeroxaxis tick type auto |
342 |
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@ zeroxaxis tick spec 0 |
343 |
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@ zeroyaxis tick on |
344 |
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@ zeroyaxis tick major 0.1 |
345 |
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@ zeroyaxis tick minor 0.05 |
346 |
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@ zeroyaxis tick offsetx 0.000000 |
347 |
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@ zeroyaxis tick offsety 0.000000 |
348 |
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@ zeroyaxis label "" |
349 |
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@ zeroyaxis label layout para |
350 |
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@ zeroyaxis label place auto |
351 |
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@ zeroyaxis label char size 1.000000 |
352 |
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@ zeroyaxis label font 4 |
353 |
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@ zeroyaxis label color 1 |
354 |
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@ zeroyaxis label linewidth 1 |
355 |
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@ zeroyaxis ticklabel off |
356 |
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@ zeroyaxis ticklabel type auto |
357 |
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@ zeroyaxis ticklabel prec 5 |
358 |
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@ zeroyaxis ticklabel format general |
359 |
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@ zeroyaxis ticklabel append "" |
360 |
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@ zeroyaxis ticklabel prepend "" |
361 |
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@ zeroyaxis ticklabel layout horizontal |
362 |
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@ zeroyaxis ticklabel place on ticks |
363 |
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@ zeroyaxis ticklabel skip 0 |
364 |
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@ zeroyaxis ticklabel stagger 0 |
365 |
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@ zeroyaxis ticklabel op left |
366 |
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@ zeroyaxis ticklabel sign normal |
367 |
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@ zeroyaxis ticklabel start type auto |
368 |
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@ zeroyaxis ticklabel start 0.000000 |
369 |
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@ zeroyaxis ticklabel stop type auto |
370 |
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@ zeroyaxis ticklabel stop 0.000000 |
371 |
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@ zeroyaxis ticklabel char size 1.000000 |
372 |
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@ zeroyaxis ticklabel font 4 |
373 |
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@ zeroyaxis ticklabel color 1 |
374 |
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@ zeroyaxis ticklabel linewidth 1 |
375 |
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@ zeroyaxis tick major off |
376 |
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@ zeroyaxis tick minor on |
377 |
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@ zeroyaxis tick default 6 |
378 |
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@ zeroyaxis tick in |
379 |
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@ zeroyaxis tick major color 1 |
380 |
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@ zeroyaxis tick major linewidth 1 |
381 |
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@ zeroyaxis tick major linestyle 1 |
382 |
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@ zeroyaxis tick minor color 1 |
383 |
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@ zeroyaxis tick minor linewidth 1 |
384 |
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@ zeroyaxis tick minor linestyle 1 |
385 |
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@ zeroyaxis tick log off |
386 |
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@ zeroyaxis tick size 1.000000 |
387 |
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@ zeroyaxis tick minor size 0.500000 |
388 |
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@ zeroyaxis bar off |
389 |
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@ zeroyaxis bar color 1 |
390 |
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@ zeroyaxis bar linestyle 1 |
391 |
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@ zeroyaxis bar linewidth 1 |
392 |
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@ zeroyaxis tick major grid off |
393 |
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@ zeroyaxis tick minor grid off |
394 |
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@ zeroyaxis tick op both |
395 |
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@ zeroyaxis tick type auto |
396 |
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|
@ zeroyaxis tick spec 0 |
397 |
|
|
@ legend on |
398 |
|
|
@ legend loctype view |
399 |
|
|
@ legend layout 0 |
400 |
|
|
@ legend vgap 2 |
401 |
|
|
@ legend hgap 1 |
402 |
|
|
@ legend length 4 |
403 |
|
|
@ legend box off |
404 |
|
|
@ legend box fill off |
405 |
|
|
@ legend box fill with color |
406 |
|
|
@ legend box fill color 0 |
407 |
|
|
@ legend box fill pattern 1 |
408 |
|
|
@ legend box color 1 |
409 |
|
|
@ legend box linewidth 1 |
410 |
|
|
@ legend box linestyle 1 |
411 |
|
|
@ legend x1 0.263736 |
412 |
|
|
@ legend y1 0.401977 |
413 |
|
|
@ legend font 0 |
414 |
|
|
@ legend char size 1.000000 |
415 |
|
|
@ legend linestyle 1 |
416 |
|
|
@ legend linewidth 1 |
417 |
|
|
@ legend color 1 |
418 |
|
|
@ legend string 0 "TIP4P" |
419 |
|
|
@ legend string 1 "TIP3P" |
420 |
|
|
@ legend string 2 "SPC/E" |
421 |
|
|
@ legend string 3 "SSD w/o Reaction Field (this work)" |
422 |
|
|
@ legend string 5 "Experiment" |
423 |
|
|
@ frame on |
424 |
|
|
@ frame type 0 |
425 |
|
|
@ frame linestyle 1 |
426 |
|
|
@ frame linewidth 1 |
427 |
|
|
@ frame color 1 |
428 |
|
|
@ frame fill off |
429 |
|
|
@ frame background color 0 |
430 |
|
|
@WITH G0 |
431 |
|
|
@G0 ON |
432 |
|
|
@TARGET S0 |
433 |
|
|
@TYPE xy |
434 |
|
|
223.15 1.01 |
435 |
|
|
235.65 1.015 |
436 |
|
|
248.15 1.019 |
437 |
|
|
260.65 1.018 |
438 |
|
|
273.15 1.011 |
439 |
|
|
285.65 1.005 |
440 |
|
|
298.15 1.001 |
441 |
|
|
310.65 0.991 |
442 |
|
|
323.15 0.981 |
443 |
|
|
335.65 0.971 |
444 |
|
|
348.15 0.961 |
445 |
|
|
360.65 0.952 |
446 |
|
|
373.15 0.931 |
447 |
|
|
& |
448 |
|
|
@TARGET S1 |
449 |
|
|
@TYPE xy |
450 |
|
|
223.15 1.065 |
451 |
|
|
235.65 1.059 |
452 |
|
|
248.15 1.049 |
453 |
|
|
260.65 1.039 |
454 |
|
|
273.15 1.023 |
455 |
|
|
285.65 1.018 |
456 |
|
|
298.15 1.002 |
457 |
|
|
310.65 0.982 |
458 |
|
|
323.15 0.977 |
459 |
|
|
335.65 0.964 |
460 |
|
|
348.15 0.953 |
461 |
|
|
360.65 0.932 |
462 |
|
|
373.15 0.914 |
463 |
|
|
& |
464 |
|
|
@TARGET S2 |
465 |
|
|
@TYPE xy |
466 |
|
|
190.3 1.0097 |
467 |
|
|
200.2 1.0185 |
468 |
|
|
209.5 1.0237 |
469 |
|
|
220.6 1.0251 |
470 |
|
|
229.9 1.0267 |
471 |
|
|
240.4 1.0262 |
472 |
|
|
250.2 1.0251 |
473 |
|
|
261.2 1.0217 |
474 |
|
|
282.2 1.016 |
475 |
|
|
307.4 1.0013 |
476 |
|
|
328.3 0.9872 |
477 |
|
|
& |
478 |
|
|
@TARGET S3 |
479 |
|
|
@TYPE xy |
480 |
|
|
225 0.987986 |
481 |
|
|
230 0.999174 |
482 |
|
|
235 1.00233 |
483 |
|
|
240 1.00394 |
484 |
|
|
245 1.00978 |
485 |
|
|
250 1.00746 |
486 |
|
|
255 1.00922 |
487 |
|
|
260 1.00465 |
488 |
|
|
265 0.998711 |
489 |
|
|
270 0.998292 |
490 |
|
|
275 0.990738 |
491 |
|
|
280 0.988012 |
492 |
|
|
285 0.980563 |
493 |
|
|
290 0.976202 |
494 |
|
|
295 0.971682 |
495 |
|
|
300 0.963872 |
496 |
|
|
325 0.922829 |
497 |
|
|
350 0.869164 |
498 |
|
|
375 0.809591 |
499 |
|
|
400 0.7353 |
500 |
|
|
& |
501 |
|
|
@TARGET S5 |
502 |
|
|
@TYPE xy |
503 |
|
|
373.15 0.958367 |
504 |
|
|
368.15 0.961903 |
505 |
|
|
363.15 0.965323 |
506 |
|
|
358.15 0.968623 |
507 |
|
|
353.15 0.971801 |
508 |
|
|
348.15 0.974852 |
509 |
|
|
343.15 0.977773 |
510 |
|
|
338.15 0.980558 |
511 |
|
|
333.15 0.983202 |
512 |
|
|
328.15 0.985698 |
513 |
|
|
323.15 0.988039 |
514 |
|
|
318.15 0.990216 |
515 |
|
|
313.15 0.992219 |
516 |
|
|
308.15 0.994035 |
517 |
|
|
303.15 0.99565 |
518 |
|
|
298.15 0.997048 |
519 |
|
|
293.15 0.998207 |
520 |
|
|
288.15 0.999103 |
521 |
|
|
283.15 0.999703 |
522 |
|
|
278.15 0.999967 |
523 |
|
|
273.15 0.999842 |
524 |
|
|
268.15 0.999259 |
525 |
|
|
263.15 0.99812 |
526 |
|
|
258.15 0.996286 |
527 |
|
|
253.15 0.99355 |
528 |
|
|
248.15 0.989588 |
529 |
|
|
243.15 0.983857 |
530 |
|
|
235.65 0.9752 |
531 |
|
|
& |