resolve some issues in .rst files detected by pandoc
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@ -487,10 +487,10 @@ updates are back-ported from the *develop* branch to the *maintenance*
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branch and occasionally merged to *stable* as an update release.
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branch and occasionally merged to *stable* as an update release.
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Furthermore, the naming of the release tags now follow the pattern
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Furthermore, the naming of the release tags now follow the pattern
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"patch_<Day><Month><Year>" to simplify comparisons between releases.
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"patch\_<Day><Month><Year>" to simplify comparisons between releases.
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For stable releases additional "stable_<Day><Month><Year>" tags are
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For stable releases additional "stable\_<Day><Month><Year>" tags are
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applied and update releases are tagged with
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applied and update releases are tagged with
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"stable_<Day><Month><Year>_update<Number>", Finally, all releases and
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"stable\_<Day><Month><Year>\_update<Number>", Finally, all releases and
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submissions are subject to automatic testing and code checks to make
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submissions are subject to automatic testing and code checks to make
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sure they compile with a variety of compilers and popular operating
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sure they compile with a variety of compilers and popular operating
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systems. Some unit and regression testing is applied as well.
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systems. Some unit and regression testing is applied as well.
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@ -131,14 +131,15 @@ timesteps is simply
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t_{hyper} = \sum_{i=1,N} B-i \cdot dt
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t_{hyper} = \sum_{i=1,N} B-i \cdot dt
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where *dt* is the timestep size defined by the :doc:`timestep <timestep>`
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where *dt* is the timestep size defined by the :doc:`timestep <timestep>`
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command. The effective time acceleration due to GHD is thus t_hyper /
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command. The effective time acceleration due to GHD is thus
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N\*dt, where N\*dt is elapsed time for a normal MD run of N timesteps.
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:math:`t_{hyper} / N * dt`, where N\*dt is elapsed time for a normal MD run
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of N timesteps.
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Note that in GHD, the boost factor varies from timestep to timestep.
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Note that in GHD, the boost factor varies from timestep to timestep. Likewise,
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Likewise, which bond has :math:`E^{max}` strain and thus which pair of
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which bond has :math:`E^{max}` strain and thus which pair of atoms the bias
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atoms the bias potential is added to, will also vary from timestep to timestep.
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potential is added to, will also vary from timestep to timestep. This is in
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This is in contrast to local hyperdynamics (LHD) where the boost
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contrast to local hyperdynamics (LHD) where the boost factor is an input
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factor is an input parameter; see the :doc:`fix hyper/local <fix_hyper_local>` page for details.
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parameter; see the :doc:`fix hyper/local <fix_hyper_local>` page for details.
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----------
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----------
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@ -178,7 +179,7 @@ time-accurate trajectory of the system.
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Note that if *Vmax* is set too small, the GHD simulation will run
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Note that if *Vmax* is set too small, the GHD simulation will run
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correctly. There will just be fewer events because the hyper time
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correctly. There will just be fewer events because the hyper time
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(t_hyper equation above) will be shorter.
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(:math:`t_{hyper}` equation above) will be shorter.
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.. note::
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.. note::
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@ -111,7 +111,7 @@ requirement, and thus a bias potential :math:`V^{max}_{ij}` will be
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applied to many bonds on the same timestep.
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applied to many bonds on the same timestep.
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In LHD, all bonds store a :math:`C_{ij}` prefactor which appears in
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In LHD, all bonds store a :math:`C_{ij}` prefactor which appears in
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the :math:`V^{max}_{ij}` and :math:`F^{max}_{ij}equations above. Note
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the :math:`V^{max}_{ij}` and :math:`F^{max}_{ij}` equations above. Note
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that the :math:`C_{ij}` factor scales the strength of the bias energy
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that the :math:`C_{ij}` factor scales the strength of the bias energy
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and forces whenever bond *ij* is the maximum strain bond in its neighborhood.
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and forces whenever bond *ij* is the maximum strain bond in its neighborhood.
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@ -269,7 +269,7 @@ inverse of the alpha parameter discussed in
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The *Btarget* argument is the desired time boost factor (a value > 1)
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The *Btarget* argument is the desired time boost factor (a value > 1)
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that all the atoms in the system will experience. The elapsed time
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that all the atoms in the system will experience. The elapsed time
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t_hyper for an LHD simulation running for *N* timesteps is simply
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:math:`t_{hyper}` for an LHD simulation running for *N* timesteps is simply
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.. math::
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.. math::
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@ -294,7 +294,7 @@ is the specified temperature of the system
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Note that if *Btarget* is set smaller than this, the LHD simulation
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Note that if *Btarget* is set smaller than this, the LHD simulation
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will run correctly. There will just be fewer events because the hyper
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will run correctly. There will just be fewer events because the hyper
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time (t_hyper equation above) will be shorter.
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time (:math:`t_{hyper}` equation above) will be shorter.
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.. note::
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.. note::
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