/usr/share/nwchem/libraries/lanl08d is in nwchem-data 6.6+r27746-2.
This file is owned by root:root, with mode 0o644.
The actual contents of the file can be viewed below.
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# Elements References
# -------- ----------
# Si P S Cl Ge As Se Br Sn Sb Te I Pb Bi: P.J. Hay and W.R. Wadt, J. Chem. Phys. 82, 284 (1985).
# Si P S Cl Ge As Se Br Sn Sb Te I Pb Bi: L.E. Roy, P.J. Hay, and R.L. Martin, J. Chem. Theory Comput. 4, 1029 (2008).
# Si P S Cl Ge As Se Br Sn Sb Te I Pb Bi: C.E. Check, T.O. Faust, J.M. Bailey, B.J. Wright, T.M. Gilbert and L.S. Sunderlin, J Phys. Chem. A 105, 8111 (2001).
#
basis "Si_LANL08d" SPHERICAL
Si S
1.2220000 1.0000000
Si S
0.2595000 1.0000000
Si S
0.0931000 1.0000000
Si P
2.5800000 1.0000000
Si P
0.2984000 1.0000000
Si P
0.0885000 1.0000000
Si P
0.0237000 1.0000000
Si D
0.2960000 1.0000000
end
basis "P_LANL08d" SPHERICAL
P S
1.5160000 1.0000000
P S
0.3369000 1.0000000
P S
0.1211000 1.0000000
P P
3.7050000 1.0000000
P P
0.3934000 1.0000000
P P
0.1190000 1.0000000
P P
0.0298000 1.0000000
P D
0.3640000 1.0000000
end
basis "S_LANL08d" SPHERICAL
S S
1.8500000 1.0000000
S S
0.4035000 1.0000000
S S
0.1438000 1.0000000
S P
4.9450000 1.0000000
S P
0.4870000 1.0000000
S P
0.1379000 1.0000000
S P
0.0347000 1.0000000
S D
0.4960000 1.0000000
end
basis "Cl_LANL08d" SPHERICAL
Cl S
2.2310000 1.0000000
Cl S
0.4720000 1.0000000
Cl S
0.1631000 1.0000000
Cl P
6.2960000 1.0000000
Cl P
0.6333000 1.0000000
Cl P
0.1819000 1.0000000
Cl P
0.0467000 1.0000000
Cl D
0.6480000 1.0000000
end
basis "Ge_LANL08d" SPHERICAL
Ge S
0.8935000 1.0000000
Ge S
0.4424000 1.0000000
Ge S
0.1162000 1.0000000
Ge P
1.8770000 1.0000000
Ge P
0.2623000 1.0000000
Ge P
0.0798000 1.0000000
Ge P
0.0209000 1.0000000
Ge D
0.2460000 1.0000000
end
basis "As_LANL08d" SPHERICAL
As S
0.9635000 1.0000000
As S
0.5427000 1.0000000
As S
0.1407000 1.0000000
As P
2.0840000 1.0000000
As P
0.3224000 1.0000000
As P
0.1020000 1.0000000
As P
0.0263000 1.0000000
As D
0.2860000 1.0000000
end
basis "Se_LANL08d" SPHERICAL
Se S
1.0330000 1.0000000
Se S
0.6521000 1.0000000
Se S
0.1660000 1.0000000
Se P
2.3660000 1.0000000
Se P
0.3833000 1.0000000
Se P
0.1186000 1.0000000
Se P
0.0328000 1.0000000
Se D
0.3630000 1.0000000
end
basis "Br_LANL08d" SPHERICAL
Br S
1.1590000 1.0000000
Br S
0.7107000 1.0000000
Br S
0.1905000 1.0000000
Br P
2.6910000 1.0000000
Br P
0.4446000 1.0000000
Br P
0.1377000 1.0000000
Br P
0.0376000 1.0000000
Br D
0.4340000 1.0000000
end
basis "Sn_LANL08d" SPHERICAL
Sn S
0.5418000 1.0000000
Sn S
0.3784000 1.0000000
Sn S
0.0926000 1.0000000
Sn P
1.0470000 1.0000000
Sn P
0.1932000 1.0000000
Sn P
0.0630000 1.0000000
Sn P
0.0174000 1.0000000
Sn D
0.1860000 1.0000000
end
basis "Sb_LANL08d" SPHERICAL
Sb S
0.5863000 1.0000000
Sb S
0.4293000 1.0000000
Sb S
0.1078000 1.0000000
Sb P
1.1110000 1.0000000
Sb P
0.2365000 1.0000000
Sb P
0.0800000 1.0000000
Sb P
0.0220000 1.0000000
Sb D
0.2070000 1.0000000
end
basis "Te_LANL08d" SPHERICAL
Te S
0.6938000 1.0000000
Te S
0.4038000 1.0000000
Te S
0.1165000 1.0000000
Te P
1.2310000 1.0000000
Te P
0.2756000 1.0000000
Te P
0.0911000 1.0000000
Te P
0.0274000 1.0000000
Te D
0.2500000 1.0000000
end
basis "I_LANL08d" SPHERICAL
I S
0.7242000 1.0000000
I S
0.4653000 1.0000000
I S
0.1336000 1.0000000
I P
1.2900000 1.0000000
I P
0.3180000 1.0000000
I P
0.1053000 1.0000000
I P
0.0308000 1.0000000
I D
0.2940000 1.0000000
end
basis "Pb_LANL08d" SPHERICAL
Pb S
0.5135000 1.0000000
Pb S
0.3756000 1.0000000
Pb S
0.0944000 1.0000000
Pb P
0.8748000 1.0000000
Pb P
0.1843000 1.0000000
Pb P
0.0598000 1.0000000
Pb P
0.0168000 1.0000000
Pb D
0.1790000 1.0000000
end
basis "Bi_LANL08d" SPHERICAL
Bi S
0.5744000 1.0000000
Bi S
0.3851000 1.0000000
Bi S
0.1050000 1.0000000
Bi P
0.9105000 1.0000000
Bi P
0.2194000 1.0000000
Bi P
0.0745000 1.0000000
Bi P
0.0204000 1.0000000
Bi D
0.1920000 1.0000000
end
ASSOCIATED_ECP "lanl2dz_ecp"
# Elements References
# -------- ----------
# Na - Hg: P. J. Hay and W. R. Wadt, J. Chem. Phys. 82, 270 (1985).
# P. J. Hay and W. R. Wadt, J. Chem. Phys. 82, 284 (1985).
# P. J. Hay and W. R. Wadt, J. Chem. Phys. 82, 299 (1985).
#
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