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

/dports/science/cp2k-data/cp2k-7.1.0/src/
H A Dmao_optimizer.F24 mao_orthogonalization,&
155 CALL mao_orthogonalization(mao_coef(ispin)%matrix, matrix_smm(1)%matrix)
170 CALL mao_orthogonalization(amat, matrix_smm(1)%matrix)
174 CALL mao_orthogonalization(amat, matrix_smm(1)%matrix)
H A Dmao_methods.F71 PUBLIC :: mao_initialization, mao_function, mao_function_gradient, mao_orthogonalization, &
180 CALL mao_orthogonalization(mao_coef, smat)
301 SUBROUTINE mao_orthogonalization(mao_coef, smat) subroutine
341 END SUBROUTINE mao_orthogonalization
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/
H A Dmao_optimizer.F24 mao_orthogonalization,&
155 CALL mao_orthogonalization(mao_coef(ispin)%matrix, matrix_smm(1)%matrix)
170 CALL mao_orthogonalization(amat, matrix_smm(1)%matrix)
174 CALL mao_orthogonalization(amat, matrix_smm(1)%matrix)
H A Dmao_methods.F71 PUBLIC :: mao_initialization, mao_function, mao_function_gradient, mao_orthogonalization, &
180 CALL mao_orthogonalization(mao_coef, smat)
301 SUBROUTINE mao_orthogonalization(mao_coef, smat) subroutine
341 END SUBROUTINE mao_orthogonalization