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Searched refs:sumi1 (Results 1 – 6 of 6) sorted by relevance

/dports/science/nwchem-data/nwchem-7.0.2-release/src/ddscf/fast/
H A Dcheby.F265 $ sumi0, sumi1, sumi2, sumi3
325 sumi1 = 0.0d0
330 sumi1 = sumi1 + cx(i)*g(i+ilo,j+jlo+1,k+klo)
334 sumj = sumj + cy(j)*sumi0 + cy(j+1)*sumi1 + cy(j+2)*sumi2 +
/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/ddscf/fast/
H A Dcheby.F265 $ sumi0, sumi1, sumi2, sumi3
325 sumi1 = 0.0d0
330 sumi1 = sumi1 + cx(i)*g(i+ilo,j+jlo+1,k+klo)
334 sumj = sumj + cy(j)*sumi0 + cy(j+1)*sumi1 + cy(j+2)*sumi2 +
/dports/science/openmx/openmx3.8/source/
H A DBand_DFT_kpath.c408 double sumi0 = 0.0; double sumi1 = 0.0; double sumi2 = 0.0; double sumi3 = 0.0; in Band_DFT_kpath_Col() local
417 sumi1 += H[i1][l].r*S[j1+1][l].i + H[i1][l].i*S[j1+1][l].r; in Band_DFT_kpath_Col()
428 C[j1+1][i1].i = sumi1; in Band_DFT_kpath_Col()
466 sumi1 += S[i1][l].r*C[j1+1][l].i - S[i1][l].i*C[j1+1][l].r; in Band_DFT_kpath_Col()
476 H[i1][j1+1].i = sumi1; in Band_DFT_kpath_Col()
1071 double sumi1 = 0.0; in Band_DFT_kpath_NonCol() local
1079 sumi1 += H[i1][l+n].r*S[j1][l].i + H[i1][l+n].i*S[j1][l].r; in Band_DFT_kpath_NonCol()
1086 C[2*j1 ][i1].i = sumi1; in Band_DFT_kpath_NonCol()
1100 double sumi1 = 0.0; in Band_DFT_kpath_NonCol() local
1107 sumi1 += S[i1][l].r*C[j1][l+n].i - S[i1][l].i*C[j1][l+n].r; in Band_DFT_kpath_NonCol()
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H A DBand_DFT_MO.c372 double sumi0 = 0.0, sumi1 = 0.0; in Band_DFT_MO_Col() local
379 sumi1 += H[spin][i1+1][l].r*S[j1][l].i + H[spin][i1+1][l].i*S[j1][l].r; in Band_DFT_MO_Col()
386 C[spin][j1][i1+1].i = sumi1; in Band_DFT_MO_Col()
H A DUnfolding_Bands.c819 double sumi0 = 0.0, sumi1 = 0.0; in Unfolding_Bands_Col() local
826 sumi1 += H[spin][i1+1][l].r*S[j1][l].i + H[spin][i1+1][l].i*S[j1][l].r; in Unfolding_Bands_Col()
833 C[spin][j1][i1+1].i = sumi1; in Unfolding_Bands_Col()
/dports/editors/yudit/yudit-3.0.7/mytool/kmap/
H A DKanji.kmap4039 "sumi1= 0x9685",