Searched defs:orbin (Results 1 – 6 of 6) sorted by relevance
| /dports/science/qwalk/mainline-1.0.1-300-g1b7e381/src/orbitals/ |
| H A D | MO_matrix.cpp | 80 void rotate_orb(istream & orbin, ostream & orbout, in rotate_orb()
148 void rotate_Corb(istream & orbin, ostream & orbout, in rotate_Corb()
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| H A D | MO_matrix_blas.cpp | 178 ifstream orbin(orbfile.c_str()); in writeorb() local
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| /dports/science/qwalk/mainline-1.0.1-300-g1b7e381/src/attic/ |
| H A D | Fitbasis_method.cpp | 122 ifstream orbin(file_list[0].c_str()); in run() local
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| H A D | overlaps.cpp | 38 void read_mo(string & orbin, int nmo, int nfunc, Array2 <doublevar> & moCoeff) { in read_mo()
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| /dports/science/qwalk/mainline-1.0.1-300-g1b7e381/utils/ |
| H A D | compare_mo.cpp | 36 void read_mo(string & orbin, int nmo, int nfunc, Array2 <double> & moCoeff) in read_mo()
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| /dports/science/quantum-espresso/q-e-qe-6.7.0/PWCOND/src/ |
| H A D | init_orbitals.f90 | 37 ioins, ilocros, irocros, orbin, orbfin, ib, lsr, nrz, & local
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