- Jan 26, 2017
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Steve Plimpton authored
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sjplimp authored
Kokkos bugfixes
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sjplimp authored
fix USER-OMP bug on per-atom data with hybrid styles
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sjplimp authored
warning fixes (Kokkos+CUDA)
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sjplimp authored
Fix skip with ghost issue
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sjplimp authored
USER-DPD: Possible uninitialized variable in pair_exp6_rx.cpp bugfix.
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Axel Kohlmeyer authored
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- Jan 25, 2017
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Dan Ibanez authored
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Dan Ibanez authored
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Dan Ibanez authored
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Dan Ibanez authored
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Dan Ibanez authored
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Dan Ibanez authored
this structure gets put inside a DualView, so these members need to be able to execute on the GPU
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Dan Ibanez authored
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Dan Ibanez authored
the compiler pointed out that boundary[2][2] doesn't exist. If I understand this correctly, those checks should be against boundary[*][0].
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Dan Ibanez authored
this #ifdef adds a return statement for little endian machines, but leaves the old one, which the compiler comlains is unreachable. this commit combines the conditionals so we can use #else
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Stan Moore authored
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Stan Moore authored
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- Jan 24, 2017
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Axel Kohlmeyer authored
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Axel Kohlmeyer authored
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- Jan 23, 2017
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Christopher Stone authored
Added explicit initialization (to zero) for several variables inside the inner j-loop to avoid using them uninitialized or from prior iterations within rmOldij_12 == 0.
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- Jan 20, 2017
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Steve Plimpton authored
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sjplimp authored
collected fixes and improvements
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sjplimp authored
Kokkos fixes
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sjplimp authored
USER-DPD another zero compute optimization
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Axel Kohlmeyer authored
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Axel Kohlmeyer authored
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Steve Plimpton authored
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- Jan 19, 2017
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Stan Moore authored
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Stan Moore authored
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- Jan 18, 2017
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Tim Mattox authored
This relates to commit 4eb08a58 that was applied to pair_dpd_fdt_energy
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Tim Mattox authored
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sjplimp authored
Added source code and documentation for USER-CGDNA
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sjplimp authored
USER-DPD: Skip a0*stuff computations, if a0 was set to zero in pair_coeff
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sjplimp authored
USER-DPD: bugfix for a segfault when using MOLECULE and DPD together.
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- Jan 17, 2017
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Tim Mattox authored
This saves around 10% of the runtime for many of our tests using SSA.
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Tim Mattox authored
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Steve Plimpton authored
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sjplimp authored
Fixes for srp example
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sjplimp authored
Neighbor fixes
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