forked from lijiext/lammps
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@4479 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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@ -112,7 +112,7 @@ if this is not the case, a dump snapshot will only be written if the
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setting of this keyword is <I>yes</I>. If it is <I>no</I>, which is the
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default, then it will not be written.
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</P>
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<P>The <I>flush</I> keyword determines whether a flush operation in invoked
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<P>The <I>flush</I> keyword determines whether a flush operation is invoked
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after a dump snapshot is written to the dump file. A flush insures
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the output in that file is current (no buffering by the OS), even if
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LAMMPS halts before the simulation completes. Flushes cannot be
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@ -105,7 +105,7 @@ if this is not the case, a dump snapshot will only be written if the
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setting of this keyword is {yes}. If it is {no}, which is the
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default, then it will not be written.
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The {flush} keyword determines whether a flush operation in invoked
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The {flush} keyword determines whether a flush operation is invoked
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after a dump snapshot is written to the dump file. A flush insures
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the output in that file is current (no buffering by the OS), even if
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LAMMPS halts before the simulation completes. Flushes cannot be
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@ -19,7 +19,7 @@
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<LI>keyword = <I>lost</I> or <I>norm</I> or <I>flush</I> or <I>line</I> or <I>format</I> or <I>temp</I> or <I>press</I> or <I>every</I>
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<I>lost</I> value = <I>error</I> or <I>warn</I> or <I>ignore</I>
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<PRE> <I>lost</I> value = <I>error</I> or <I>warn</I> or <I>ignore</I>
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<I>norm</I> value = <I>yes</I> or <I>no</I>
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<I>flush</I> value = <I>yes</I> or <I>no</I>
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<I>line</I> value = <I>one</I> or <I>multi</I>
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@ -29,7 +29,8 @@
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<I>temp</I> value = compute ID that calculates a temperature
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<I>press</I> value = compute ID that calculates a pressure
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<I>every</I> value = v_name
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v_name = an equal-style variable name
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v_name = an equal-style variable name
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</PRE>
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</UL>
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<P><B>Examples:</B>
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@ -24,7 +24,7 @@ keyword = {lost} or {norm} or {flush} or {line} or {format} or {temp} or {press}
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{temp} value = compute ID that calculates a temperature
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{press} value = compute ID that calculates a pressure
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{every} value = v_name
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v_name = an equal-style variable name
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v_name = an equal-style variable name :pre
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:ule
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[Examples:]
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@ -415,12 +415,13 @@ the ID of a compute defined elsewhere in the input script. As
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discussed in the doc page for the <A HREF = "compute.html">compute</A> command,
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computes can produce global, per-atom, or local values. Only global
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and per-atom values can be used in a variable. Computes can also
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produce a scalar, vector, or array. An equal-style variable can use
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scalar values, which means a scalar itself, or an element of a vector
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or array. Atom-style variables can use either scalar or vector
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values. A vector value can be a vector itself, or a column of an
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array. See the doc pages for individual computes to see what kind of
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values they produce.
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produce a scalar, vector, or array. An equal-style variable can only
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use scalar values, which means a global scalar, or an element of a
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global or per-atom vector or array. Atom-style variables can use the
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same scalar values. They can also use per-atom vector values. A
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vector value can be a per-atom vector itself, or a column of an
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per-atom array. See the doc pages for individual computes to see what
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kind of values they produce.
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</P>
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<P>Examples of different kinds of compute references are as follows.
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There is no ambiguity as to what a reference means, since computes
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@ -443,15 +444,17 @@ elsewhere in the input script. As discussed in the doc page for the
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<A HREF = "fix.html">fix</A> command, fixes can produce global, per-atom, or local
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values. Only global and per-atom values can be used in a variable.
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Fixes can also produce a scalar, vector, or array. An equal-style
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variable can use scalar values, which means a scalar itself, or an
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element of a vector or array. Atom-style variables can use either
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scalar or vector values. A vector value can be a vector itself, or a
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column of an array. See the doc pages for individual fixes to see
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what kind of values they produce.
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variable can only use scalar values, which means a global scalar, or
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an element of a global or per-atom vector or array. Atom-style
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variables can use the same scalar values. They can also use per-atom
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vector values. A vector value can be a per-atom vector itself, or a
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column of an per-atom array. See the doc pages for individual fixes
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to see what kind of values they produce.
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</P>
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<P>The different kinds of fix references are exactly the same as the
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compute references listed in the above table, where "c_" is replaced
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by "f_".
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by "f_". Again, there is no ambiguity as to what a reference means,
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since fixes only produce global or per-atom quantities, never both.
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</P>
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<DIV ALIGN=center><TABLE BORDER=1 >
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<TR><TD >f_ID</TD><TD > global scalar, or per-atom vector</TD></TR>
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@ -474,14 +477,15 @@ which will cause those variables to be evaluated. The name in the
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reference should be replaced by the name of a variable defined
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elsewhere in the input script. As discussed on this doc page,
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atom-style variables generate a per-atom vector of values; all other
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variable styles generate a single scalar value. An equal-style
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variable can use scalar values produce by another variable, but not
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per-atom vectors. Atom-style variables can use either scalar or
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per-atom vector values.
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variable styles generate a global scalar value. An equal-style
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variable can reference a global scalar value produced by another
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variable, but not a per-atom vector produced by an atom-style
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variable. Atom-style variables can reference either global scalar or
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per-atom vector values produced by kind of variable.
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</P>
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<P>Examples of different kinds of variable references are as follows.
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There is no ambiguity as to what a reference means, since variables
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only produce scalar or per-atom vectors, never both.
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produce only a global scalar or a per-atom vectors, never both.
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</P>
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<DIV ALIGN=center><TABLE BORDER=1 >
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<TR><TD >v_name</TD><TD > scalar, or per-atom vector</TD></TR>
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@ -414,12 +414,13 @@ the ID of a compute defined elsewhere in the input script. As
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discussed in the doc page for the "compute"_compute.html command,
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computes can produce global, per-atom, or local values. Only global
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and per-atom values can be used in a variable. Computes can also
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produce a scalar, vector, or array. An equal-style variable can use
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scalar values, which means a scalar itself, or an element of a vector
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or array. Atom-style variables can use either scalar or vector
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values. A vector value can be a vector itself, or a column of an
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array. See the doc pages for individual computes to see what kind of
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values they produce.
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produce a scalar, vector, or array. An equal-style variable can only
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use scalar values, which means a global scalar, or an element of a
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global or per-atom vector or array. Atom-style variables can use the
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same scalar values. They can also use per-atom vector values. A
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vector value can be a per-atom vector itself, or a column of an
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per-atom array. See the doc pages for individual computes to see what
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kind of values they produce.
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Examples of different kinds of compute references are as follows.
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There is no ambiguity as to what a reference means, since computes
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@ -440,15 +441,17 @@ elsewhere in the input script. As discussed in the doc page for the
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"fix"_fix.html command, fixes can produce global, per-atom, or local
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values. Only global and per-atom values can be used in a variable.
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Fixes can also produce a scalar, vector, or array. An equal-style
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variable can use scalar values, which means a scalar itself, or an
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element of a vector or array. Atom-style variables can use either
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scalar or vector values. A vector value can be a vector itself, or a
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column of an array. See the doc pages for individual fixes to see
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what kind of values they produce.
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variable can only use scalar values, which means a global scalar, or
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an element of a global or per-atom vector or array. Atom-style
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variables can use the same scalar values. They can also use per-atom
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vector values. A vector value can be a per-atom vector itself, or a
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column of an per-atom array. See the doc pages for individual fixes
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to see what kind of values they produce.
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The different kinds of fix references are exactly the same as the
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compute references listed in the above table, where "c_" is replaced
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by "f_".
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by "f_". Again, there is no ambiguity as to what a reference means,
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since fixes only produce global or per-atom quantities, never both.
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f_ID: global scalar, or per-atom vector
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f_ID\[I\]: Ith element of global vector, or atom I's value in per-atom vector, or Ith column from per-atom array
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@ -469,14 +472,15 @@ which will cause those variables to be evaluated. The name in the
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reference should be replaced by the name of a variable defined
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elsewhere in the input script. As discussed on this doc page,
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atom-style variables generate a per-atom vector of values; all other
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variable styles generate a single scalar value. An equal-style
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variable can use scalar values produce by another variable, but not
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per-atom vectors. Atom-style variables can use either scalar or
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per-atom vector values.
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variable styles generate a global scalar value. An equal-style
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variable can reference a global scalar value produced by another
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variable, but not a per-atom vector produced by an atom-style
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variable. Atom-style variables can reference either global scalar or
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per-atom vector values produced by kind of variable.
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Examples of different kinds of variable references are as follows.
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There is no ambiguity as to what a reference means, since variables
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only produce scalar or per-atom vectors, never both.
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produce only a global scalar or a per-atom vectors, never both.
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v_name: scalar, or per-atom vector
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v_name\[I\]: atom I's value in per-atom vector :tb(s=:)
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