Searched defs:mo0 (Results 1 – 9 of 9) sorted by relevance
| /dports/science/py-pyscf/pyscf-2.0.1/examples/mcscf/61-rcas_vs_ucas/ |
| H A D | o2-scan.py | 8 def run(b, mo0=None, dm0=None): argument
37 def urun(b, mo0=None, dm0=None): argument
71 mo0 = mc.mo_coeff variable
87 mo0 = mc.mo_coeff variable
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| /dports/science/py-pyscf/pyscf-2.0.1/examples/scf/ |
| H A D | 50-mom-deltaSCF.py | 47 mo0 = a.mo_coeff variable
79 mo0 = c.mo_coeff variable
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| H A D | 51-elecoup_mom.py | 46 mo0 = a.mo_coeff variable
66 mo0 = scf.chkfile.load('nh2cho_s0.chkfile', 'scf/mo_coeff') variable
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| /dports/science/py-pyscf/pyscf-2.0.1/examples/mcscf/32-beh2_scan/ |
| H A D | BeH2-scan.py | 11 def run(i, dm0, mo0, ci0): argument
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| /dports/science/cdcl/dcl-5.4.8-C/src/grph2/ucpack/ |
| H A D | ucyamn.c | 44 static integer id0, mo0, iy0, idi, iml, moi, iyi, itdi; in ucyamn_() local
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| H A D | ucxamn.c | 44 static integer id0, mo0, iy0, idi, iml, moi, iyi, itdi; in ucxamn_() local
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| H A D | ucyayr.c | 48 static integer id0, mo0, iy0, idi, moi, iyi, iyl, itdi; in ucyayr_() local
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| H A D | ucxayr.c | 48 static integer id0, mo0, iy0, idi, moi, iyi, iyl, itdi; in ucxayr_() local
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| /dports/math/scilab/scilab-6.1.1/scilab/modules/graphic_objects/src/cpp/ |
| H A D | DecompositionUtils.cpp | 193 double mo0[3]; in getDecomposedQuadTriangleIndices() local
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