Searched refs:XZZ (Results 26 – 50 of 143) sorted by relevance
123456
| /dports/science/py-pyscf/pyscf-2.0.1/pyscf/hessian/ |
| H A D | rks.py | 173 XXX, XXY, XXZ, XYY, XYZ, XZZ = 10, 11, 12, 13, 14, 15 variable
227 contract_(vmat[2], ao, [XXZ,XYZ,XZZ], wv, mask)
230 contract_(vmat[5], ao, [XZZ,YZZ,ZZZ], wv, mask)
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| /dports/biology/freebayes/freebayes-1.3.5/contrib/htslib/test/ |
| H A D | fastqs.fq | 472 \aYY_[FY\T`X^Vd`OY\[[^U_V[R^T[_ZDc^La\HYYO\S[c^Ld`Nc_QAZaZaYaY`XZZ\[aZZ[aZ[aZ[aZY`Z[`ZWeaVJ\[aZaY`X…
496 \aYY_[EY\T`X^Vd`OY\[[^U_V[R^T[_ZBc^La\GYYO\S[c^Ld`Nc_Q;ZaZaYaY`XZZ\[aZZ[aZ[aZ[aZY`Z[`ZWeaVJ\[aZaY`X…
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| /dports/biology/htslib/htslib-1.14/test/ |
| H A D | fastqs.fq | 472 \aYY_[FY\T`X^Vd`OY\[[^U_V[R^T[_ZDc^La\HYYO\S[c^Ld`Nc_QAZaZaYaY`XZZ\[aZZ[aZ[aZ[aZY`Z[`ZWeaVJ\[aZaY`X…
496 \aYY_[EY\T`X^Vd`OY\[[^U_V[R^T[_ZBc^La\GYYO\S[c^Ld`Nc_Q;ZaZaYaY`XZZ\[aZZ[aZ[aZ[aZY`Z[`ZWeaVJ\[aZaY`X…
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| /dports/devel/py-cclib/cclib-1.7.1/data/QChem/basicQChem4.2/ |
| H A D | water_mp2.out | 194 YYZ 0.0136 XZZ 0.0000 YZZ 0.0000
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| H A D | water_mp3.out | 277 YYZ 0.0136 XZZ 0.0000 YZZ 0.0000
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| H A D | water_ir.out | 185 YYZ 0.0235 XZZ 0.0000 YZZ 0.0000
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| H A D | water_ccsd.out | 317 YYZ 0.0136 XZZ 0.0000 YZZ 0.0000
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| H A D | water_ccd.out | 306 YYZ 0.0136 XZZ 0.0000 YZZ 0.0000
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| H A D | water_cis.out | 297 YYZ 0.0136 XZZ 0.0000 YZZ 0.0000
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| H A D | Trp_polar.out | 617 YYZ 104.7308 XZZ -300.0616 YZZ -33.0220
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| H A D | water_ccsd(t).out | 319 YYZ 0.0136 XZZ 0.0000 YZZ 0.0000
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| H A D | water_mp4.out | 461 YYZ 0.0136 XZZ 0.0000 YZZ 0.0000
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| H A D | water_mp4sdq.out | 457 YYZ 0.0136 XZZ 0.0000 YZZ 0.0000
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| H A D | dvb_td.out | 394 YYZ 0.0000 XZZ 0.0000 YZZ 0.0000
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| H A D | C_bigbasis.out | 1780 YYZ 0.0000 XZZ -0.0000 YZZ -0.0000
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| H A D | water_cis(d).out | 467 YYZ 0.0136 XZZ 0.0000 YZZ 0.0000
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| /dports/science/cdk/cdk-cdk-2.3/base/testdata/src/test/resources/data/gaussian/ |
| H A D | ch3oh_g94.out | 252 XXY= -2.1328 XXZ= 0.0000 XZZ= -0.4325 YZZ= -1.0457
628 XXY= -2.1333 XXZ= 0.0000 XZZ= -0.4331 YZZ= -1.0448
1185 XXY= -2.1333 XXZ= 0.0000 XZZ= -0.4331 YZZ= -1.0448
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| /dports/devel/py-cclib/cclib-1.7.1/data/QChem/basicQChem5.1/ |
| H A D | water_mp2.out | 239 YYZ 0.0136 XZZ 0.0000 YZZ 0.0000
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| H A D | dvb_dispersion_bp86_d3zero.out | 314 YYZ 0.0000 XZZ -0.0000 YZZ -0.0000
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| H A D | water_ir.out | 229 YYZ 0.0235 XZZ -0.0000 YZZ -0.0000
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| H A D | water_mp3.out | 323 YYZ 0.0136 XZZ 0.0000 YZZ -0.0000
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| H A D | Trp_polar.out | 654 YYZ 104.7308 XZZ -300.0616 YZZ -33.0220
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| H A D | water_ccsd.out | 366 YYZ 0.0136 XZZ 0.0000 YZZ -0.0000
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| H A D | water_ccd.out | 353 YYZ 0.0136 XZZ 0.0000 YZZ -0.0000
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| H A D | water_cis.out | 340 YYZ 0.0136 XZZ -0.0000 YZZ -0.0000
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