File
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Last Change |
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 ../
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FluctuatingChargePropagator.hpp
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1913 (12 years ago) by jmichalk: Fixed some bugs in the flucQ constraints. |
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FluctuatingChargePropagator.cpp
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1921 (12 years ago) by gezelter: Fixed a few DumpWriter / FlucQ bugs. Still working on Ewald, updated Quadrupolar test structures. |
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FluctuatingChargeParameters.hpp
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1908 (12 years ago) by gezelter: Added infrastructure for region-constrained fluctuating charges. |
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FluctuatingChargeParameters.cpp
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1908 (12 years ago) by gezelter: Added infrastructure for region-constrained fluctuating charges. |
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FluctuatingChargeObjectiveFunction.hpp
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1879 (12 years ago) by gezelter: MERGE OpenMD development 1783:1878 into trunk |
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FluctuatingChargeObjectiveFunction.cpp
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1929 (12 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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FluctuatingChargeNVT.hpp
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1879 (12 years ago) by gezelter: MERGE OpenMD development 1783:1878 into trunk |
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FluctuatingChargeNVT.cpp
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1879 (12 years ago) by gezelter: MERGE OpenMD development 1783:1878 into trunk |
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FluctuatingChargeLangevin.hpp
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1879 (12 years ago) by gezelter: MERGE OpenMD development 1783:1878 into trunk |
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FluctuatingChargeLangevin.cpp
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1879 (12 years ago) by gezelter: MERGE OpenMD development 1783:1878 into trunk |
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FluctuatingChargeConstraints.hpp
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1913 (12 years ago) by jmichalk: Fixed some bugs in the flucQ constraints. |
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FluctuatingChargeConstraints.cpp
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1939 (12 years ago) by gezelter: Some fixes for MSVC compilation |