added citation to doc
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@ -42,9 +42,11 @@ Simulations under extensional flow may be carried out for an
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indefinite amount of time. It is an implementation of the boundary
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indefinite amount of time. It is an implementation of the boundary
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conditions from "(Dobson)"_#Dobson, and also uses numerical lattice reduction
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conditions from "(Dobson)"_#Dobson, and also uses numerical lattice reduction
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as was proposed by "(Hunt)"_#Hunt. The lattice reduction algorithm is from
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as was proposed by "(Hunt)"_#Hunt. The lattice reduction algorithm is from
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"(Semaev)"_Semaev. The package is intended for simulations of
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"(Semaev)"_Semaev. The fix is intended for simulations of
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homogeneous flows, and integrates the SLLOD equations of motion,
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homogeneous flows, and integrates the SLLOD equations of motion,
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originally proposed by Hoover and Ladd (see "(Evans and Morriss)"_#Sllod).
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originally proposed by Hoover and Ladd (see "(Evans and Morriss)"_#Sllod).
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Additional detail about this implementation can be found in
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"(Nicholson and Rutledge)"_#Nicholson.
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The applied flow field is set by the {eps} keyword. The values {edot_x}
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The applied flow field is set by the {eps} keyword. The values {edot_x}
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and {edot_y} correspond to the strain rates in the xx and yy directions.
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and {edot_y} correspond to the strain rates in the xx and yy directions.
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@ -204,3 +206,6 @@ The reason for this change is given in "fix nvt/sllod"_fix_nvt_sllod.html.
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:link(Sllod)
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:link(Sllod)
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[(Evans and Morriss)] Evans and Morriss, Phys Rev A, 30, 1528 (1984).
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[(Evans and Morriss)] Evans and Morriss, Phys Rev A, 30, 1528 (1984).
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:link(Nicholson)
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[(Nicholson and Rutledge)] Nicholson and Rutledge, J Chem Phys, 145, 244903 (2016).
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