MOLPRO Basis Query, element=Ne, basis=ROOS, l=s
Basis Ne s ROOS
Primitives | Contractions... |
166165.080000 | 0.000047 | -0.000011 | 0.000014 | -0.000013 | 0.000019 | -0.000018 |
23107.524000 | 0.000401 | -0.000094 | 0.000115 | -0.000102 | 0.000138 | -0.000220 |
5060.153900 | 0.002193 | -0.000518 | 0.000649 | -0.000655 | 0.000926 | -0.000639 |
1384.612300 | 0.009588 | -0.002266 | 0.002763 | -0.002321 | 0.003106 | -0.006142 |
436.512580 | 0.035073 | -0.008459 | 0.010734 | -0.011383 | 0.016398 | -0.007755 |
153.471480 | 0.104652 | -0.026049 | 0.031832 | -0.025343 | 0.034075 | -0.092274 |
59.389087 | 0.237712 | -0.065360 | 0.087196 | -0.105838 | 0.160921 | -0.020143 |
24.861967 | 0.369606 | -0.122266 | 0.152981 | -0.098372 | 0.137760 | -0.847008 |
11.015704 | 0.306161 | -0.158571 | 0.284798 | -0.523027 | 0.884741 | 0.683663 |
4.965175 | 0.084199 | -0.006029 | -0.192955 | 1.122623 | -2.832242 | 2.152176 |
1.936503 | 0.003703 | 0.382896 | -1.322588 | 0.490140 | 2.191011 | -4.935538 |
0.765728 | 0.000965 | 0.538865 | 0.490128 | -1.737905 | 0.445210 | 5.660715 |
0.295538 | 0.000054 | 0.211449 | 0.754618 | 0.397787 | -2.207583 | -4.079378 |
0.103438 | 0.000027 | 0.002805 | 0.061367 | 0.890041 | 1.527256 | 1.543755 |
Comment: P.-O. Widmark, P.-A. Malmqvist and B.O. Roos, Theor. Chim. Acta 77(1990)291