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Searched refs:augsol (Results 1 – 4 of 4) sorted by relevance

/dports/science/erkale-pseudopotentials/erkale-870e772f09631b3dbdd99a18e4f3d4786d684a01/src/xrs/
H A Dmain.cpp176 uscf_t augsol(sol); in augmented_solution() local
181 augsol.Pa.zeros(Ntot,Ntot); in augmented_solution()
187 augsol.P=augsol.Pa+augsol.Pb; in augmented_solution()
237 grid.construct(augsol.Pa,augsol.Pb,dft.gridtol,dft.x_func,dft.c_func); in augmented_solution()
275 H=augsol.Ha; in augmented_solution()
277 H=augsol.Hb; in augmented_solution()
332 augsol.Ca=Ca; in augmented_solution()
333 augsol.Ea=Ea; in augmented_solution()
335 augsol.Cb=Ca; in augmented_solution()
336 augsol.Eb=Ea; in augmented_solution()
[all …]
/dports/science/erkale/erkale-8297aefe5aac9dbbb291e04c07661f3cff94a99a/src/xrs/
H A Dmain.cpp176 uscf_t augsol(sol); in augmented_solution() local
181 augsol.Pa.zeros(Ntot,Ntot); in augmented_solution()
187 augsol.P=augsol.Pa+augsol.Pb; in augmented_solution()
237 grid.construct(augsol.Pa,augsol.Pb,dft.gridtol,dft.x_func,dft.c_func); in augmented_solution()
274 H=augsol.Ha; in augmented_solution()
276 H=augsol.Hb; in augmented_solution()
331 augsol.Ca=Ca; in augmented_solution()
332 augsol.Ea=Ea; in augmented_solution()
334 augsol.Cb=Ca; in augmented_solution()
335 augsol.Eb=Ea; in augmented_solution()
[all …]
/dports/math/ipopt/Ipopt-3.12.13/Ipopt/src/Algorithm/
H A DIpStdAugSystemSolver.cpp211 SmartPtr<CompoundVector> augsol = in MultiSolve() local
213 augsol->SetCompNonConst(0, *sol_xV[i]); in MultiSolve()
214 augsol->SetCompNonConst(1, *sol_sV[i]); in MultiSolve()
215 augsol->SetCompNonConst(2, *sol_cV[i]); in MultiSolve()
216 augsol->SetCompNonConst(3, *sol_dV[i]); in MultiSolve()
217 augmented_solV[i] = GetRawPtr(augsol); in MultiSolve()
/dports/science/simbody/simbody-Simbody-3.7/SimTKmath/Optimizers/src/IpOpt/
H A DIpStdAugSystemSolver.cpp206 SmartPtr<CompoundVector> augsol = in MultiSolve() local
208 augsol->SetCompNonConst(0, *sol_xV[i]); in MultiSolve()
209 augsol->SetCompNonConst(1, *sol_sV[i]); in MultiSolve()
210 augsol->SetCompNonConst(2, *sol_cV[i]); in MultiSolve()
211 augsol->SetCompNonConst(3, *sol_dV[i]); in MultiSolve()
212 augmented_solV[i] = GetRawPtr(augsol); in MultiSolve()