 ../
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antlr/
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1879
(12 years ago)
by gezelter:
MERGE OpenMD development 1783:1878 into trunk
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applications/
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1934
(11 years ago)
by gezelter:
Added OH bond time correlation function
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brains/
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1930
(11 years ago)
by gezelter:
region fixes, performance boosts
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clusters/
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1879
(12 years ago)
by gezelter:
MERGE OpenMD development 1783:1878 into trunk
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constraints/
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1879
(12 years ago)
by gezelter:
MERGE OpenMD development 1783:1878 into trunk
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flucq/
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1929
(11 years ago)
by gezelter:
Backing out fluc-rho and putting back the Electrostatic fluctuating
charge with coulomb integrals for atoms within a region.
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hydrodynamics/
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1879
(12 years ago)
by gezelter:
MERGE OpenMD development 1783:1878 into trunk
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integrators/
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1915
(11 years ago)
by gezelter:
Added Legendre Correlation function (as a function of Z), working on architecture for Ewald
Fixed some bugs in FlucQ
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io/
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1921
(11 years ago)
by gezelter:
Fixed a few DumpWriter / FlucQ bugs. Still working on Ewald, updated
Quadrupolar test structures.
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lattice/
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1879
(12 years ago)
by gezelter:
MERGE OpenMD development 1783:1878 into trunk
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math/
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1933
(11 years ago)
by gezelter:
Fixed a bug (I think) that was caused by a cross product name collision.
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mdParser/
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1902
(11 years ago)
by gezelter:
Added a satellites keyword to the inversion block.
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nonbonded/
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1934
(11 years ago)
by gezelter:
Added OH bond time correlation function
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optimization/
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1880
(12 years ago)
by gezelter:
Preparing for official 2.1 release (clean-up)
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parallel/
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1931
(11 years ago)
by gezelter:
fixed a sameRegion initialization issue
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perturbations/
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1908
(11 years ago)
by gezelter:
Added infrastructure for region-constrained fluctuating charges.
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primitives/
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1908
(11 years ago)
by gezelter:
Added infrastructure for region-constrained fluctuating charges.
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restraints/
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1879
(12 years ago)
by gezelter:
MERGE OpenMD development 1783:1878 into trunk
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rnemd/
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1903
(11 years ago)
by gezelter:
Test to see if we can eliminate a bug in MPI runs involving RNEMD.
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selection/
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1931
(11 years ago)
by gezelter:
fixed a sameRegion initialization issue
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types/
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1908
(11 years ago)
by gezelter:
Added infrastructure for region-constrained fluctuating charges.
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utils/
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1896
(11 years ago)
by gezelter:
Speedup tests
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visitors/
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1879
(12 years ago)
by gezelter:
MERGE OpenMD development 1783:1878 into trunk
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config.h.cmake
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1796
(12 years ago)
by gezelter:
Updating MPI calls to C++, fixing a DumpWriter bug, cleaning cruft
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