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multiscale
lammps
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0db2a079
Commit
0db2a079
authored
8 years ago
by
Axel Kohlmeyer
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another workaround for duplicate labels (which sphinx does not like)
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33412c76
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doc/src/temper_grem.txt
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0db2a079
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@@ -32,7 +32,7 @@ Run a parallel tempering or replica exchange simulation in LAMMPS
partition mode using multiple generalized replicas (ensembles) of a
system defined by "fix grem"_fix_grem.html, which stands for the
generalized replica exchange method (gREM) originally developed by
"(Kim)"_#Kim. It uses non-Boltzmann ensembles to sample over first
"(Kim)"_#Kim
Straub
. It uses non-Boltzmann ensembles to sample over first
order phase transitions. The is done by defining replicas with an
enthalpy dependent effective temperature
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@@ -105,5 +105,5 @@ This command must be used with "fix grem"_fix_grem.html.
[Default:] none
:link(Kim)
:link(Kim
Straub
)
[(Kim)] Kim, Keyes, Straub, J Chem Phys, 132, 224107 (2010).
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