Activity for RAtom
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Zbigniew Romanowski committed [r199]
Update of src/Makefile
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Small improvements of src/Makefile.
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Makefile in the top directory was updated.
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Command .PHONY added to Makefiles.
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RAtom released /README
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Revision 1.6.6
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Function Rho::Init was refactored.
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In documentation dependency graph was updated.
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Class Pot was refactored. Now, class Pot holds ...
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Function Pot::SetXc refactored.
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In class Pot unused code was removed.
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In class State variables related to angular qua...
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In class KohnSham variables related to angular ...
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The name of member EigProb::m_l was changed to ...
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Makefiles were updated.
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README was updated and extended.
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Documentation for algoritm implemented in class...
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Documentation for algoritm implemented in class...
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In documentation dependency graph was updated.
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Method NonLinKs::Scf was refactored.
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In function NonLinKs::Scf the function std::swa...
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Update of reference data.
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Now, the class StateSet is static. New class Ei...
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Potential Pot is passad as the argument to func...
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Documentation for KohnSham class was updated. M...
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Function Pot::SolvePoisson was changed to Pot::...
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Member PoissonProb::m_rho is no longer needed.
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The interface of PoissonProb was simplyfied.
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Some names of functions arguments were changed ...
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The member EltInfo:m_eigVal was removed, since ...
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Now, the function PoissonProb::MaxMinCoef retur...
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Tiny editorial changes in the class PoissonProb.
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Slight modification of reference solutions.
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Documentation for dependency graph is updated.
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Class OdeProb and class Prob are no longer needed.
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class PoissonProb refactored.
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The method of evaluation of hartree potential w...
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Revision 1.6.5
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Removed unused code.
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Class Energy was refactored. The names of helpe...
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In documentation dependency graph was updated.
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Class Energy was refactored. The use of switch ...
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Object of class Energy is no longer the member ...
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Removed unused code in Energy class.
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Editorial changes in class NonLinKs.
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Class NonLinKs does not hold member pointers an...
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In class NonLinKs the member of type Energy is ...
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Class NonLinKs refactored: member KohnSham is o...
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Class KsSolver was renamed to RAtom.
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In documentation dependency graph was updated.
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Configuration parameters were moved from KohnSh...
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In documentation dependency graph was updated.
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The class PotRad is no longer needed.
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In class EigProb documenation was updated.
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In class EigProb documenation was updated.
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Exception handling was changed from class KsSol...
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Documentation for dependency graph was updated.
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In class EigProb small editorial changes were m...
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In class Element function Element::X holds prop...
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In class EigProb the unused code was removed.
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Class EigProb refactored. Now, it is not derive...
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Documentation for class EigProb is updated.
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Documentation about class depndency was updated.
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Class ParamDb was refactord. Now, it has static...
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After unifying the degree of applied Gauss quad...
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Removed unsued code.
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In documentation, dependency graph is updated.
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Gauss has only static members. Now, only one ob...
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Now, class Lobatto has only static members. Its...
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The switch was changed to array.
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Lobato polynomials are written in easier to rea...
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Each polynomial is calculated by its own function.
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Dependency graph between classes was added into...
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Function ApproxSolver::GetCoef was changed.
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Memember Approx::m_M no longer needed.
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In function Rho::Calc nacked pointer was change...
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Small editiorial changes in file rho.cpp
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The class ApproxSolver further refactored.
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Small editorial changes in class AproxSolver.
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Small editorial changes in class AproxSolver.
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Revision 1.6.4
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Update of reference data.
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New class FunTilde was created based on the sou...
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Class AproxSolver uses reference instead of nac...
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Class Approx was split into two classes: AproxS...
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Class Mesh from class Aprox removed.
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In function Approx::SolveAdapt one constant got...
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Class Gauss in Approx and Prob is static.
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Documentation of adaptive approximation algorit...
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Fixed wrong value in Lobbato K matrix.
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Each of class Approx, Lobatto, Prob has its own...
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In Lobatto class simplified evalaution of matri...
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Unused code from class Rho was removed.
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Class Lobatto uses class Gauss.
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Refactored Lobbato class.
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Prob class is no longer protected derived form ...
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Prob class is no longer protected derived form ...
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