Loading doc/run.html +10 −0 Original line number Diff line number Diff line Loading @@ -156,6 +156,16 @@ print Coord = $q particular atom between runs. Note that the variable "$q" will be evaluated afresh each time the print command is executed. </P> <P>Note that by using the line continuation character "&", the run every command can be spread across many lines, though it is still a single command: </P> <PRE>run 100000 every 1000 & "print Minimum value = $a" & "print Maximum value = $b" & "print Temp = $c" & "print Press = $d" </PRE> <P>If the <I>pre</I> and <I>post</I> options are set to "no" when used with the <I>every</I> keyword, then the 1st run will do the full setup and the last run will print the full timing summary, but these operations will be Loading doc/run.txt +10 −0 Original line number Diff line number Diff line Loading @@ -149,6 +149,16 @@ which does 3 runs of 2000 steps and prints the x-coordinate of a particular atom between runs. Note that the variable "$q" will be evaluated afresh each time the print command is executed. Note that by using the line continuation character "&", the run every command can be spread across many lines, though it is still a single command: run 100000 every 1000 & "print Minimum value = $a" & "print Maximum value = $b" & "print Temp = $c" & "print Press = $d" :pre If the {pre} and {post} options are set to "no" when used with the {every} keyword, then the 1st run will do the full setup and the last run will print the full timing summary, but these operations will be Loading Loading
doc/run.html +10 −0 Original line number Diff line number Diff line Loading @@ -156,6 +156,16 @@ print Coord = $q particular atom between runs. Note that the variable "$q" will be evaluated afresh each time the print command is executed. </P> <P>Note that by using the line continuation character "&", the run every command can be spread across many lines, though it is still a single command: </P> <PRE>run 100000 every 1000 & "print Minimum value = $a" & "print Maximum value = $b" & "print Temp = $c" & "print Press = $d" </PRE> <P>If the <I>pre</I> and <I>post</I> options are set to "no" when used with the <I>every</I> keyword, then the 1st run will do the full setup and the last run will print the full timing summary, but these operations will be Loading
doc/run.txt +10 −0 Original line number Diff line number Diff line Loading @@ -149,6 +149,16 @@ which does 3 runs of 2000 steps and prints the x-coordinate of a particular atom between runs. Note that the variable "$q" will be evaluated afresh each time the print command is executed. Note that by using the line continuation character "&", the run every command can be spread across many lines, though it is still a single command: run 100000 every 1000 & "print Minimum value = $a" & "print Maximum value = $b" & "print Temp = $c" & "print Press = $d" :pre If the {pre} and {post} options are set to "no" when used with the {every} keyword, then the 1st run will do the full setup and the last run will print the full timing summary, but these operations will be Loading
