| 1 | %BASIS "6-311G**" CARTESIAN
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| 2 | basis:(
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| 3 | %Elements References
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| 4 | %-------- ----------
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| 5 | %H, Li - Ne: R. Krishnan, J.S. Binkley, R. Seeger and J.A. Pople,
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| 6 | % J. Chem. Phys. 72, 650 (1980)
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| 7 | %Na - Ar: A.D. McLean and G.S. Chandler J. Chem. Phys. 72, 5639, (1980).
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| 8 | %K - Ca: J-P. Blaudeau, M. P. McGrath, L.A. Curtiss and L. Radom,
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| 9 | % J. Chem. Phys. 107, 5016 (1997).
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| 10 | %Ga - Kr: L. A. Curtiss, M. P. McGrath, J-P. Blandeau, N. E. Davis,
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| 11 | % R. C. Binning, Jr. L. Radom, J. Chem. Phys. 103, 6104 (1995).
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| 12 | %I : M.N. Glukhovstev, A. pross, M.P. McGrath, L. Radom, J. Chem. Phys.
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| 13 | % 103, 1878 (1995)
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| 14 | %Elements References
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| 15 | %-------- ----------
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| 16 | %H - Ar: R. Krishnan, J.S. Binkley, R. Seeger, J.A. Pople, J. Chem. Phys. 72,
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| 17 | % 650 (1980)
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| 18 | %
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| 19 | %
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| 20 | % BASIS SET: (5s) -> [3s]
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| 21 | hydrogen: "6-311G**": [
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| 22 | (type: [am = s]
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| 23 | {exp coef:0} = {
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| 24 | 33.865000000 0.02549380
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| 25 | 5.094790000 0.19037300
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| 26 | 1.158790000 0.85216100
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| 27 | })
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| 28 | (type: [am = s]
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| 29 | {exp coef:0} = {
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| 30 | 0.325840000 1.00000000
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| 31 | })
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| 32 | (type: [am = s]
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| 33 | {exp coef:0} = {
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| 34 | 0.102741000 1.00000000
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| 35 | })
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| 36 | % AUGMENTING FUNCTIONS: (1p)
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| 37 | (type: [am = p]
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| 38 | {exp coef:0} = {
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| 39 | 0.75000000 1.00000000
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| 40 | })
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| 41 | ]
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| 42 | %
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| 43 | % BASIS SET: (5s) -> [3s]
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| 44 | helium: "6-311G**": [
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| 45 | (type: [am = s]
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| 46 | {exp coef:0} = {
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| 47 | 98.124300000 0.02874520
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| 48 | 14.768900000 0.20806100
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| 49 | 3.318830000 0.83763500
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| 50 | })
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| 51 | (type: [am = s]
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| 52 | {exp coef:0} = {
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| 53 | 0.874047000 1.00000000
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| 54 | })
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| 55 | (type: [am = s]
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| 56 | {exp coef:0} = {
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| 57 | 0.244564000 1.00000000
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| 58 | })
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| 59 | % AUGMENTING FUNCTIONS: (1p)
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| 60 | (type: [am = p]
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| 61 | {exp coef:0} = {
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| 62 | 0.75000000 1.00000000
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| 63 | })
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| 64 | ]
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| 65 | %
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| 66 | % BASIS SET: (11s,5p) -> [4s,3p]
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| 67 | lithium: "6-311G**": [
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| 68 | (type: [am = s]
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| 69 | {exp coef:0} = {
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| 70 | 900.460000000 0.00228704
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| 71 | 134.433000000 0.01763500
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| 72 | 30.436500000 0.08734340
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| 73 | 8.626390000 0.28097700
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| 74 | 2.483320000 0.65874100
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| 75 | 0.303179000 0.11871200
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| 76 | })
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| 77 | (type: [am = p am = s]
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| 78 | {exp coef:1 coef:0} = {
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| 79 | 4.868900000 0.09332930 0.03276610
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| 80 | 0.856924000 0.94304500 0.15979200
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| 81 | 0.243227000 -0.00279827 0.88566700
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| 82 | })
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| 83 | (type: [am = p am = s]
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| 84 | {exp coef:1 coef:0} = {
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| 85 | 0.063507000 1.00000000 1.00000000
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| 86 | })
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| 87 | (type: [am = p am = s]
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| 88 | {exp coef:1 coef:0} = {
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| 89 | 0.024368300 1.00000000 1.00000000
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| 90 | })
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| 91 | % AUGMENTING FUNCTIONS: (1d)
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| 92 | (type: [(am = d puream = 1)]
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| 93 | {exp coef:0} = {
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| 94 | 0.20000000 1.00000000
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| 95 | })
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| 96 | ]
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| 97 | %
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| 98 | % BASIS SET: (11s,5p) -> [4s,3p]
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| 99 | beryllium: "6-311G**": [
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| 100 | (type: [am = s]
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| 101 | {exp coef:0} = {
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| 102 | 1682.800000000 0.00228574
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| 103 | 251.715000000 0.01759380
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| 104 | 57.411600000 0.08633150
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| 105 | 16.517100000 0.28183500
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| 106 | 4.853640000 0.64059400
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| 107 | 0.626863000 0.14446700
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| 108 | })
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| 109 | (type: [am = p am = s]
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| 110 | {exp coef:1 coef:0} = {
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| 111 | 8.309380000 0.10862100 0.03613440
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| 112 | 1.740750000 0.92730100 0.21695800
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| 113 | 0.485816000 -0.00297169 0.84183900
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| 114 | })
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| 115 | (type: [am = p am = s]
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| 116 | {exp coef:1 coef:0} = {
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| 117 | 0.163613000 1.00000000 1.00000000
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| 118 | })
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| 119 | (type: [am = p am = s]
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| 120 | {exp coef:1 coef:0} = {
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| 121 | 0.056728500 1.00000000 1.00000000
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| 122 | })
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| 123 | % AUGMENTING FUNCTIONS: (1d)
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| 124 | (type: [(am = d puream = 1)]
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| 125 | {exp coef:0} = {
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| 126 | 0.25500000 1.00000000
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| 127 | })
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| 128 | ]
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| 129 | %
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| 130 | % BASIS SET: (11s,5p) -> [4s,3p]
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| 131 | boron: "6-311G**": [
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| 132 | (type: [am = s]
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| 133 | {exp coef:0} = {
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| 134 | 2858.890000000 0.00215375
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| 135 | 428.140000000 0.01658230
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| 136 | 97.528200000 0.08218700
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| 137 | 27.969300000 0.27661800
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| 138 | 8.215770000 0.62931600
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| 139 | 1.112780000 0.17377000
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| 140 | })
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| 141 | (type: [am = p am = s]
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| 142 | {exp coef:1 coef:0} = {
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| 143 | 13.241500000 0.11744300 0.04181000
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| 144 | 3.001660000 0.91800200 0.23657500
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| 145 | 0.912856000 -0.00265105 0.81621400
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| 146 | })
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| 147 | (type: [am = p am = s]
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| 148 | {exp coef:1 coef:0} = {
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| 149 | 0.315454000 1.00000000 1.00000000
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| 150 | })
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| 151 | (type: [am = p am = s]
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| 152 | {exp coef:1 coef:0} = {
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| 153 | 0.098856300 1.00000000 1.00000000
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| 154 | })
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| 155 | % AUGMENTING FUNCTIONS: (1d)
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| 156 | (type: [(am = d puream = 1)]
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| 157 | {exp coef:0} = {
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| 158 | 0.40100000 1.00000000
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| 159 | })
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| 160 | ]
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| 161 | %
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| 162 | % BASIS SET: (11s,5p) -> [4s,3p]
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| 163 | carbon: "6-311G**": [
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| 164 | (type: [am = s]
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| 165 | {exp coef:0} = {
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| 166 | 4563.240000000 0.00196665
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| 167 | 682.024000000 0.01523060
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| 168 | 154.973000000 0.07612690
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| 169 | 44.455300000 0.26080100
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| 170 | 13.029000000 0.61646200
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| 171 | 1.827730000 0.22100600
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| 172 | })
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| 173 | (type: [am = p am = s]
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| 174 | {exp coef:1 coef:0} = {
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| 175 | 20.964200000 0.11466000 0.04024870
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| 176 | 4.803310000 0.91999900 0.23759400
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| 177 | 1.459330000 -0.00303068 0.81585400
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| 178 | })
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| 179 | (type: [am = p am = s]
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| 180 | {exp coef:1 coef:0} = {
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| 181 | 0.483456000 1.00000000 1.00000000
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| 182 | })
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| 183 | (type: [am = p am = s]
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| 184 | {exp coef:1 coef:0} = {
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| 185 | 0.145585000 1.00000000 1.00000000
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| 186 | })
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| 187 | % AUGMENTING FUNCTIONS: (1d)
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| 188 | (type: [(am = d puream = 1)]
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| 189 | {exp coef:0} = {
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| 190 | 0.62600000 1.00000000
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| 191 | })
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| 192 | ]
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| 193 | %
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| 194 | % BASIS SET: (11s,5p) -> [4s,3p]
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| 195 | nitrogen: "6-311G**": [
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| 196 | (type: [am = s]
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| 197 | {exp coef:0} = {
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| 198 | 6293.480000000 0.00196979
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| 199 | 949.044000000 0.01496130
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| 200 | 218.776000000 0.07350060
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| 201 | 63.691600000 0.24893700
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| 202 | 18.828200000 0.60246000
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| 203 | 2.720230000 0.25620200
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| 204 | })
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| 205 | (type: [am = p am = s]
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| 206 | {exp coef:1 coef:0} = {
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| 207 | 30.633100000 0.11190600 0.03831190
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| 208 | 7.026140000 0.92166600 0.23740300
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| 209 | 2.112050000 -0.00256919 0.81759200
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| 210 | })
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| 211 | (type: [am = p am = s]
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| 212 | {exp coef:1 coef:0} = {
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| 213 | 0.684009000 1.00000000 1.00000000
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| 214 | })
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| 215 | (type: [am = p am = s]
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| 216 | {exp coef:1 coef:0} = {
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| 217 | 0.200878000 1.00000000 1.00000000
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| 218 | })
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| 219 | % AUGMENTING FUNCTIONS: (1d)
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| 220 | (type: [(am = d puream = 1)]
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| 221 | {exp coef:0} = {
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| 222 | 0.91300000 1.00000000
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| 223 | })
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| 224 | ]
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| 225 | %
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| 226 | % BASIS SET: (11s,5p) -> [4s,3p]
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| 227 | oxygen: "6-311G**": [
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| 228 | (type: [am = s]
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| 229 | {exp coef:0} = {
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| 230 | 8588.500000000 0.00189515
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| 231 | 1297.230000000 0.01438590
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| 232 | 299.296000000 0.07073200
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| 233 | 87.377100000 0.24000100
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| 234 | 25.678900000 0.59479700
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| 235 | 3.740040000 0.28080200
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| 236 | })
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| 237 | (type: [am = p am = s]
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| 238 | {exp coef:1 coef:0} = {
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| 239 | 42.117500000 0.11388900 0.03651140
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| 240 | 9.628370000 0.92081100 0.23715300
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| 241 | 2.853320000 -0.00327447 0.81970200
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| 242 | })
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| 243 | (type: [am = p am = s]
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| 244 | {exp coef:1 coef:0} = {
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| 245 | 0.905661000 1.00000000 1.00000000
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| 246 | })
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| 247 | (type: [am = p am = s]
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| 248 | {exp coef:1 coef:0} = {
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| 249 | 0.255611000 1.00000000 1.00000000
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| 250 | })
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| 251 | % AUGMENTING FUNCTIONS: (1d)
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| 252 | (type: [(am = d puream = 1)]
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| 253 | {exp coef:0} = {
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| 254 | 1.29200000 1.00000000
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| 255 | })
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| 256 | ]
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| 257 | %
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| 258 | % BASIS SET: (11s,5p) -> [4s,3p]
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| 259 | fluorine: "6-311G**": [
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| 260 | (type: [am = s]
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| 261 | {exp coef:0} = {
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| 262 | 11427.100000000 0.00180093
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| 263 | 1722.350000000 0.01374190
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| 264 | 395.746000000 0.06813340
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| 265 | 115.139000000 0.23332500
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| 266 | 33.602600000 0.58908600
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| 267 | 4.919010000 0.29950500
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| 268 | })
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| 269 | (type: [am = p am = s]
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| 270 | {exp coef:1 coef:0} = {
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| 271 | 55.444100000 0.11453600 0.03546090
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| 272 | 12.632300000 0.92051200 0.23745100
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| 273 | 3.717560000 -0.00337804 0.82045800
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| 274 | })
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| 275 | (type: [am = p am = s]
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| 276 | {exp coef:1 coef:0} = {
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| 277 | 1.165450000 1.00000000 1.00000000
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| 278 | })
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| 279 | (type: [am = p am = s]
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| 280 | {exp coef:1 coef:0} = {
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| 281 | 0.321892000 1.00000000 1.00000000
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| 282 | })
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| 283 | % AUGMENTING FUNCTIONS: (1d)
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| 284 | (type: [(am = d puream = 1)]
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| 285 | {exp coef:0} = {
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| 286 | 1.75000000 1.00000000
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| 287 | })
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| 288 | ]
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| 289 | %
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| 290 | % BASIS SET: (11s,5p) -> [4s,3p]
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| 291 | neon: "6-311G**": [
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| 292 | (type: [am = s]
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| 293 | {exp coef:0} = {
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| 294 | 13995.700000000 0.00183276
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| 295 | 2117.100000000 0.01388270
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| 296 | 490.425000000 0.06806870
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| 297 | 143.833000000 0.23132800
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| 298 | 41.926500000 0.58589000
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| 299 | 6.156840000 0.30588300
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| 300 | })
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| 301 | (type: [am = p am = s]
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| 302 | {exp coef:1 coef:0} = {
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| 303 | 69.121100000 0.11914900 0.03565740
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| 304 | 15.835000000 0.91737500 0.23947700
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| 305 | 4.673260000 -0.00405839 0.81846100
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| 306 | })
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| 307 | (type: [am = p am = s]
|
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| 308 | {exp coef:1 coef:0} = {
|
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| 309 | 1.457560000 1.00000000 1.00000000
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| 310 | })
|
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| 311 | (type: [am = p am = s]
|
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| 312 | {exp coef:1 coef:0} = {
|
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| 313 | 0.397057000 1.00000000 1.00000000
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| 314 | })
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| 315 | % AUGMENTING FUNCTIONS: (1d)
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| 316 | (type: [(am = d puream = 1)]
|
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| 317 | {exp coef:0} = {
|
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| 318 | 2.30400000 1.00000000
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| 319 | })
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| 320 | ]
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| 321 | %
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| 322 | % BASIS SET: (12s,9p) -> [6s,5p]
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| 323 | sodium: "6-311G**": [
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| 324 | (type: [am = s]
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| 325 | {exp coef:0} = {
|
|---|
| 326 | 36166.400000000 0.00103200
|
|---|
| 327 | 5372.580000000 0.00807100
|
|---|
| 328 | 1213.210000000 0.04212900
|
|---|
| 329 | 339.623000000 0.16978900
|
|---|
| 330 | 109.553000000 0.51462100
|
|---|
| 331 | 38.777300000 0.37981700
|
|---|
| 332 | })
|
|---|
| 333 | (type: [am = s]
|
|---|
| 334 | {exp coef:0} = {
|
|---|
| 335 | 38.777300000 0.37476200
|
|---|
| 336 | 14.575900000 0.57576900
|
|---|
| 337 | 5.269930000 0.11293300
|
|---|
| 338 | })
|
|---|
| 339 | (type: [am = s]
|
|---|
| 340 | {exp coef:0} = {
|
|---|
| 341 | 1.827770000 1.00000000
|
|---|
| 342 | })
|
|---|
| 343 | (type: [am = s]
|
|---|
| 344 | {exp coef:0} = {
|
|---|
| 345 | 0.619948000 1.00000000
|
|---|
| 346 | })
|
|---|
| 347 | (type: [am = s]
|
|---|
| 348 | {exp coef:0} = {
|
|---|
| 349 | 0.057240000 1.00000000
|
|---|
| 350 | })
|
|---|
| 351 | (type: [am = s]
|
|---|
| 352 | {exp coef:0} = {
|
|---|
| 353 | 0.024048000 1.00000000
|
|---|
| 354 | })
|
|---|
| 355 | (type: [am = p]
|
|---|
| 356 | {exp coef:0} = {
|
|---|
| 357 | 144.645000000 0.01148500
|
|---|
| 358 | 33.907400000 0.08238300
|
|---|
| 359 | 10.628500000 0.31965800
|
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| 360 | 3.823890000 0.70129500
|
|---|
| 361 | })
|
|---|
| 362 | (type: [am = p]
|
|---|
| 363 | {exp coef:0} = {
|
|---|
| 364 | 1.444290000 0.63850600
|
|---|
| 365 | 0.552621000 0.42536500
|
|---|
| 366 | })
|
|---|
| 367 | (type: [am = p]
|
|---|
| 368 | {exp coef:0} = {
|
|---|
| 369 | 0.188720000 1.00000000
|
|---|
| 370 | })
|
|---|
| 371 | (type: [am = p]
|
|---|
| 372 | {exp coef:0} = {
|
|---|
| 373 | 0.046501000 1.00000000
|
|---|
| 374 | })
|
|---|
| 375 | (type: [am = p]
|
|---|
| 376 | {exp coef:0} = {
|
|---|
| 377 | 0.016285000 1.00000000
|
|---|
| 378 | })
|
|---|
| 379 | % AUGMENTING FUNCTIONS: (1d)
|
|---|
| 380 | (type: [(am = d puream = 1)]
|
|---|
| 381 | {exp coef:0} = {
|
|---|
| 382 | 0.17500000 1.00000000
|
|---|
| 383 | })
|
|---|
| 384 | ]
|
|---|
| 385 | %
|
|---|
| 386 | % BASIS SET: (12s,9p) -> [6s,5p]
|
|---|
| 387 | magnesium: "6-311G**": [
|
|---|
| 388 | (type: [am = s]
|
|---|
| 389 | {exp coef:0} = {
|
|---|
| 390 | 43866.500000000 0.00091800
|
|---|
| 391 | 6605.370000000 0.00704700
|
|---|
| 392 | 1513.260000000 0.03594100
|
|---|
| 393 | 432.317000000 0.14146100
|
|---|
| 394 | 142.149000000 0.42676400
|
|---|
| 395 | 51.398300000 0.49797500
|
|---|
| 396 | })
|
|---|
| 397 | (type: [am = s]
|
|---|
| 398 | {exp coef:0} = {
|
|---|
| 399 | 51.398300000 0.25135500
|
|---|
| 400 | 19.919600000 0.61867100
|
|---|
| 401 | 8.024740000 0.18841700
|
|---|
| 402 | })
|
|---|
| 403 | (type: [am = s]
|
|---|
| 404 | {exp coef:0} = {
|
|---|
| 405 | 2.508170000 1.00000000
|
|---|
| 406 | })
|
|---|
| 407 | (type: [am = s]
|
|---|
| 408 | {exp coef:0} = {
|
|---|
| 409 | 0.871531000 1.00000000
|
|---|
| 410 | })
|
|---|
| 411 | (type: [am = s]
|
|---|
| 412 | {exp coef:0} = {
|
|---|
| 413 | 0.108188000 1.00000000
|
|---|
| 414 | })
|
|---|
| 415 | (type: [am = s]
|
|---|
| 416 | {exp coef:0} = {
|
|---|
| 417 | 0.040130000 1.00000000
|
|---|
| 418 | })
|
|---|
| 419 | (type: [am = p]
|
|---|
| 420 | {exp coef:0} = {
|
|---|
| 421 | 193.854000000 0.01018800
|
|---|
| 422 | 45.442000000 0.07536000
|
|---|
| 423 | 14.186400000 0.30741900
|
|---|
| 424 | 5.057510000 0.71757500
|
|---|
| 425 | })
|
|---|
| 426 | (type: [am = p]
|
|---|
| 427 | {exp coef:0} = {
|
|---|
| 428 | 1.888610000 0.66733900
|
|---|
| 429 | 0.722652000 0.39464900
|
|---|
| 430 | })
|
|---|
| 431 | (type: [am = p]
|
|---|
| 432 | {exp coef:0} = {
|
|---|
| 433 | 0.236417000 1.00000000
|
|---|
| 434 | })
|
|---|
| 435 | (type: [am = p]
|
|---|
| 436 | {exp coef:0} = {
|
|---|
| 437 | 0.093358000 1.00000000
|
|---|
| 438 | })
|
|---|
| 439 | (type: [am = p]
|
|---|
| 440 | {exp coef:0} = {
|
|---|
| 441 | 0.034809000 1.00000000
|
|---|
| 442 | })
|
|---|
| 443 | % AUGMENTING FUNCTIONS: (1d)
|
|---|
| 444 | (type: [(am = d puream = 1)]
|
|---|
| 445 | {exp coef:0} = {
|
|---|
| 446 | 0.17500000 1.00000000
|
|---|
| 447 | })
|
|---|
| 448 | ]
|
|---|
| 449 | %
|
|---|
| 450 | % BASIS SET: (12s,9p) -> [6s,5p]
|
|---|
| 451 | aluminum: "6-311G**": [
|
|---|
| 452 | (type: [am = s]
|
|---|
| 453 | {exp coef:0} = {
|
|---|
| 454 | 54866.489000000 0.00083900
|
|---|
| 455 | 8211.766500000 0.00652700
|
|---|
| 456 | 1866.176100000 0.03366600
|
|---|
| 457 | 531.129340000 0.13290200
|
|---|
| 458 | 175.117970000 0.40126600
|
|---|
| 459 | 64.005500000 0.53133800
|
|---|
| 460 | })
|
|---|
| 461 | (type: [am = s]
|
|---|
| 462 | {exp coef:0} = {
|
|---|
| 463 | 64.005500000 0.20230500
|
|---|
| 464 | 25.292507000 0.62479000
|
|---|
| 465 | 10.534910000 0.22743900
|
|---|
| 466 | })
|
|---|
| 467 | (type: [am = s]
|
|---|
| 468 | {exp coef:0} = {
|
|---|
| 469 | 3.206711000 1.00000000
|
|---|
| 470 | })
|
|---|
| 471 | (type: [am = s]
|
|---|
| 472 | {exp coef:0} = {
|
|---|
| 473 | 1.152555000 1.00000000
|
|---|
| 474 | })
|
|---|
| 475 | (type: [am = s]
|
|---|
| 476 | {exp coef:0} = {
|
|---|
| 477 | 0.176678000 1.00000000
|
|---|
| 478 | })
|
|---|
| 479 | (type: [am = s]
|
|---|
| 480 | {exp coef:0} = {
|
|---|
| 481 | 0.065237000 1.00000000
|
|---|
| 482 | })
|
|---|
| 483 | (type: [am = p]
|
|---|
| 484 | {exp coef:0} = {
|
|---|
| 485 | 259.283620000 0.00944800
|
|---|
| 486 | 61.076870000 0.07097400
|
|---|
| 487 | 19.303237000 0.29563600
|
|---|
| 488 | 7.010882000 0.72821900
|
|---|
| 489 | })
|
|---|
| 490 | (type: [am = p]
|
|---|
| 491 | {exp coef:0} = {
|
|---|
| 492 | 2.673865000 0.64446700
|
|---|
| 493 | 1.036596000 0.41741300
|
|---|
| 494 | })
|
|---|
| 495 | (type: [am = p]
|
|---|
| 496 | {exp coef:0} = {
|
|---|
| 497 | 0.316819000 1.00000000
|
|---|
| 498 | })
|
|---|
| 499 | (type: [am = p]
|
|---|
| 500 | {exp coef:0} = {
|
|---|
| 501 | 0.114257000 1.00000000
|
|---|
| 502 | })
|
|---|
| 503 | (type: [am = p]
|
|---|
| 504 | {exp coef:0} = {
|
|---|
| 505 | 0.041397000 1.00000000
|
|---|
| 506 | })
|
|---|
| 507 | % AUGMENTING FUNCTIONS: (1d)
|
|---|
| 508 | (type: [(am = d puream = 1)]
|
|---|
| 509 | {exp coef:0} = {
|
|---|
| 510 | 0.32500000 1.00000000
|
|---|
| 511 | })
|
|---|
| 512 | ]
|
|---|
| 513 | %
|
|---|
| 514 | % BASIS SET: (12s,9p) -> [6s,5p]
|
|---|
| 515 | silicon: "6-311G**": [
|
|---|
| 516 | (type: [am = s]
|
|---|
| 517 | {exp coef:0} = {
|
|---|
| 518 | 69379.230000000 0.00075700
|
|---|
| 519 | 10354.940000000 0.00593200
|
|---|
| 520 | 2333.879600000 0.03108800
|
|---|
| 521 | 657.142950000 0.12496700
|
|---|
| 522 | 214.301130000 0.38689700
|
|---|
| 523 | 77.629168000 0.55488800
|
|---|
| 524 | })
|
|---|
| 525 | (type: [am = s]
|
|---|
| 526 | {exp coef:0} = {
|
|---|
| 527 | 77.629168000 0.17788100
|
|---|
| 528 | 30.630807000 0.62776500
|
|---|
| 529 | 12.801295000 0.24762300
|
|---|
| 530 | })
|
|---|
| 531 | (type: [am = s]
|
|---|
| 532 | {exp coef:0} = {
|
|---|
| 533 | 3.926866000 1.00000000
|
|---|
| 534 | })
|
|---|
| 535 | (type: [am = s]
|
|---|
| 536 | {exp coef:0} = {
|
|---|
| 537 | 1.452343000 1.00000000
|
|---|
| 538 | })
|
|---|
| 539 | (type: [am = s]
|
|---|
| 540 | {exp coef:0} = {
|
|---|
| 541 | 0.256234000 1.00000000
|
|---|
| 542 | })
|
|---|
| 543 | (type: [am = s]
|
|---|
| 544 | {exp coef:0} = {
|
|---|
| 545 | 0.094279000 1.00000000
|
|---|
| 546 | })
|
|---|
| 547 | (type: [am = p]
|
|---|
| 548 | {exp coef:0} = {
|
|---|
| 549 | 335.483190000 0.00886600
|
|---|
| 550 | 78.900366000 0.06829900
|
|---|
| 551 | 24.988150000 0.29095800
|
|---|
| 552 | 9.219711000 0.73211700
|
|---|
| 553 | })
|
|---|
| 554 | (type: [am = p]
|
|---|
| 555 | {exp coef:0} = {
|
|---|
| 556 | 3.621140000 0.61987900
|
|---|
| 557 | 1.451310000 0.43914800
|
|---|
| 558 | })
|
|---|
| 559 | (type: [am = p]
|
|---|
| 560 | {exp coef:0} = {
|
|---|
| 561 | 0.504977000 1.00000000
|
|---|
| 562 | })
|
|---|
| 563 | (type: [am = p]
|
|---|
| 564 | {exp coef:0} = {
|
|---|
| 565 | 0.186317000 1.00000000
|
|---|
| 566 | })
|
|---|
| 567 | (type: [am = p]
|
|---|
| 568 | {exp coef:0} = {
|
|---|
| 569 | 0.065432000 1.00000000
|
|---|
| 570 | })
|
|---|
| 571 | % AUGMENTING FUNCTIONS: (1d)
|
|---|
| 572 | (type: [(am = d puream = 1)]
|
|---|
| 573 | {exp coef:0} = {
|
|---|
| 574 | 0.45000000 1.00000000
|
|---|
| 575 | })
|
|---|
| 576 | ]
|
|---|
| 577 | %
|
|---|
| 578 | % BASIS SET: (12s,9p) -> [6s,5p]
|
|---|
| 579 | phosphorus: "6-311G**": [
|
|---|
| 580 | (type: [am = s]
|
|---|
| 581 | {exp coef:0} = {
|
|---|
| 582 | 77492.400000000 0.00078100
|
|---|
| 583 | 11605.800000000 0.00606800
|
|---|
| 584 | 2645.960000000 0.03116000
|
|---|
| 585 | 754.976000000 0.12343100
|
|---|
| 586 | 248.755000000 0.37820900
|
|---|
| 587 | 91.156500000 0.56326200
|
|---|
| 588 | })
|
|---|
| 589 | (type: [am = s]
|
|---|
| 590 | {exp coef:0} = {
|
|---|
| 591 | 91.156500000 0.16025500
|
|---|
| 592 | 36.225700000 0.62764700
|
|---|
| 593 | 15.211300000 0.26384900
|
|---|
| 594 | })
|
|---|
| 595 | (type: [am = s]
|
|---|
| 596 | {exp coef:0} = {
|
|---|
| 597 | 4.794170000 1.00000000
|
|---|
| 598 | })
|
|---|
| 599 | (type: [am = s]
|
|---|
| 600 | {exp coef:0} = {
|
|---|
| 601 | 1.807930000 1.00000000
|
|---|
| 602 | })
|
|---|
| 603 | (type: [am = s]
|
|---|
| 604 | {exp coef:0} = {
|
|---|
| 605 | 0.356816000 1.00000000
|
|---|
| 606 | })
|
|---|
| 607 | (type: [am = s]
|
|---|
| 608 | {exp coef:0} = {
|
|---|
| 609 | 0.114783000 1.00000000
|
|---|
| 610 | })
|
|---|
| 611 | (type: [am = p]
|
|---|
| 612 | {exp coef:0} = {
|
|---|
| 613 | 384.843000000 0.00920600
|
|---|
| 614 | 90.552100000 0.06987400
|
|---|
| 615 | 29.133900000 0.29247000
|
|---|
| 616 | 10.886200000 0.72810300
|
|---|
| 617 | })
|
|---|
| 618 | (type: [am = p]
|
|---|
| 619 | {exp coef:0} = {
|
|---|
| 620 | 4.352590000 0.62834900
|
|---|
| 621 | 1.777060000 0.42804400
|
|---|
| 622 | })
|
|---|
| 623 | (type: [am = p]
|
|---|
| 624 | {exp coef:0} = {
|
|---|
| 625 | 0.697005000 1.00000000
|
|---|
| 626 | })
|
|---|
| 627 | (type: [am = p]
|
|---|
| 628 | {exp coef:0} = {
|
|---|
| 629 | 0.253532000 1.00000000
|
|---|
| 630 | })
|
|---|
| 631 | (type: [am = p]
|
|---|
| 632 | {exp coef:0} = {
|
|---|
| 633 | 0.068493000 1.00000000
|
|---|
| 634 | })
|
|---|
| 635 | % AUGMENTING FUNCTIONS: (1d)
|
|---|
| 636 | (type: [(am = d puream = 1)]
|
|---|
| 637 | {exp coef:0} = {
|
|---|
| 638 | 0.55000000 1.00000000
|
|---|
| 639 | })
|
|---|
| 640 | ]
|
|---|
| 641 | %
|
|---|
| 642 | % BASIS SET: (12s,9p) -> [6s,5p]
|
|---|
| 643 | sulfur: "6-311G**": [
|
|---|
| 644 | (type: [am = s]
|
|---|
| 645 | {exp coef:0} = {
|
|---|
| 646 | 93413.400000000 0.00074300
|
|---|
| 647 | 13961.700000000 0.00579300
|
|---|
| 648 | 3169.910000000 0.02995400
|
|---|
| 649 | 902.456000000 0.11902800
|
|---|
| 650 | 297.158000000 0.36843200
|
|---|
| 651 | 108.702000000 0.57729900
|
|---|
| 652 | })
|
|---|
| 653 | (type: [am = s]
|
|---|
| 654 | {exp coef:0} = {
|
|---|
| 655 | 108.702000000 0.14318600
|
|---|
| 656 | 43.155300000 0.62446500
|
|---|
| 657 | 18.107900000 0.28336600
|
|---|
| 658 | })
|
|---|
| 659 | (type: [am = s]
|
|---|
| 660 | {exp coef:0} = {
|
|---|
| 661 | 5.560090000 1.00000000
|
|---|
| 662 | })
|
|---|
| 663 | (type: [am = s]
|
|---|
| 664 | {exp coef:0} = {
|
|---|
| 665 | 2.131830000 1.00000000
|
|---|
| 666 | })
|
|---|
| 667 | (type: [am = s]
|
|---|
| 668 | {exp coef:0} = {
|
|---|
| 669 | 0.420403000 1.00000000
|
|---|
| 670 | })
|
|---|
| 671 | (type: [am = s]
|
|---|
| 672 | {exp coef:0} = {
|
|---|
| 673 | 0.136045000 1.00000000
|
|---|
| 674 | })
|
|---|
| 675 | (type: [am = p]
|
|---|
| 676 | {exp coef:0} = {
|
|---|
| 677 | 495.040000000 0.00830900
|
|---|
| 678 | 117.221000000 0.06402400
|
|---|
| 679 | 37.774900000 0.27761400
|
|---|
| 680 | 14.058400000 0.74507600
|
|---|
| 681 | })
|
|---|
| 682 | (type: [am = p]
|
|---|
| 683 | {exp coef:0} = {
|
|---|
| 684 | 5.565740000 0.61371200
|
|---|
| 685 | 2.262970000 0.44381800
|
|---|
| 686 | })
|
|---|
| 687 | (type: [am = p]
|
|---|
| 688 | {exp coef:0} = {
|
|---|
| 689 | 0.807994000 1.00000000
|
|---|
| 690 | })
|
|---|
| 691 | (type: [am = p]
|
|---|
| 692 | {exp coef:0} = {
|
|---|
| 693 | 0.277460000 1.00000000
|
|---|
| 694 | })
|
|---|
| 695 | (type: [am = p]
|
|---|
| 696 | {exp coef:0} = {
|
|---|
| 697 | 0.077141000 1.00000000
|
|---|
| 698 | })
|
|---|
| 699 | % AUGMENTING FUNCTIONS: (1d)
|
|---|
| 700 | (type: [(am = d puream = 1)]
|
|---|
| 701 | {exp coef:0} = {
|
|---|
| 702 | 0.65000000 1.00000000
|
|---|
| 703 | })
|
|---|
| 704 | ]
|
|---|
| 705 | %
|
|---|
| 706 | % BASIS SET: (12s,9p) -> [6s,5p]
|
|---|
| 707 | chlorine: "6-311G**": [
|
|---|
| 708 | (type: [am = s]
|
|---|
| 709 | {exp coef:0} = {
|
|---|
| 710 | 105819.000000000 0.00073800
|
|---|
| 711 | 15872.000000000 0.00571800
|
|---|
| 712 | 3619.650000000 0.02949500
|
|---|
| 713 | 1030.800000000 0.11728600
|
|---|
| 714 | 339.908000000 0.36294900
|
|---|
| 715 | 124.538000000 0.58414900
|
|---|
| 716 | })
|
|---|
| 717 | (type: [am = s]
|
|---|
| 718 | {exp coef:0} = {
|
|---|
| 719 | 124.538000000 0.13417700
|
|---|
| 720 | 49.513500000 0.62425000
|
|---|
| 721 | 20.805600000 0.29175600
|
|---|
| 722 | })
|
|---|
| 723 | (type: [am = s]
|
|---|
| 724 | {exp coef:0} = {
|
|---|
| 725 | 6.583460000 1.00000000
|
|---|
| 726 | })
|
|---|
| 727 | (type: [am = s]
|
|---|
| 728 | {exp coef:0} = {
|
|---|
| 729 | 2.564680000 1.00000000
|
|---|
| 730 | })
|
|---|
| 731 | (type: [am = s]
|
|---|
| 732 | {exp coef:0} = {
|
|---|
| 733 | 0.559763000 1.00000000
|
|---|
| 734 | })
|
|---|
| 735 | (type: [am = s]
|
|---|
| 736 | {exp coef:0} = {
|
|---|
| 737 | 0.183273000 1.00000000
|
|---|
| 738 | })
|
|---|
| 739 | (type: [am = p]
|
|---|
| 740 | {exp coef:0} = {
|
|---|
| 741 | 589.776000000 0.00239100
|
|---|
| 742 | 139.849000000 0.01850400
|
|---|
| 743 | 45.141300000 0.08137700
|
|---|
| 744 | 16.873300000 0.22155200
|
|---|
| 745 | 6.741100000 0.77256900
|
|---|
| 746 | })
|
|---|
| 747 | (type: [am = p]
|
|---|
| 748 | {exp coef:0} = {
|
|---|
| 749 | 6.741100000 -1.57224400
|
|---|
| 750 | 2.771520000 0.99238900
|
|---|
| 751 | })
|
|---|
| 752 | (type: [am = p]
|
|---|
| 753 | {exp coef:0} = {
|
|---|
| 754 | 1.023870000 1.00000000
|
|---|
| 755 | })
|
|---|
| 756 | (type: [am = p]
|
|---|
| 757 | {exp coef:0} = {
|
|---|
| 758 | 0.381368000 1.00000000
|
|---|
| 759 | })
|
|---|
| 760 | (type: [am = p]
|
|---|
| 761 | {exp coef:0} = {
|
|---|
| 762 | 0.109437000 1.00000000
|
|---|
| 763 | })
|
|---|
| 764 | % AUGMENTING FUNCTIONS: (1d)
|
|---|
| 765 | (type: [(am = d puream = 1)]
|
|---|
| 766 | {exp coef:0} = {
|
|---|
| 767 | 0.75000000 1.00000000
|
|---|
| 768 | })
|
|---|
| 769 | ]
|
|---|
| 770 | %
|
|---|
| 771 | % BASIS SET: (12s,9p) -> [6s,5p]
|
|---|
| 772 | argon: "6-311G**": [
|
|---|
| 773 | (type: [am = s]
|
|---|
| 774 | {exp coef:0} = {
|
|---|
| 775 | 118022.380000000 0.00074700
|
|---|
| 776 | 17683.541000000 0.00579000
|
|---|
| 777 | 4027.765700000 0.02991900
|
|---|
| 778 | 1145.397700000 0.11920600
|
|---|
| 779 | 377.163750000 0.36902800
|
|---|
| 780 | 138.159690000 0.57645900
|
|---|
| 781 | })
|
|---|
| 782 | (type: [am = s]
|
|---|
| 783 | {exp coef:0} = {
|
|---|
| 784 | 138.159690000 0.14392700
|
|---|
| 785 | 54.989117000 0.62293800
|
|---|
| 786 | 23.170667000 0.28396400
|
|---|
| 787 | })
|
|---|
| 788 | (type: [am = s]
|
|---|
| 789 | {exp coef:0} = {
|
|---|
| 790 | 7.377860000 1.00000000
|
|---|
| 791 | })
|
|---|
| 792 | (type: [am = s]
|
|---|
| 793 | {exp coef:0} = {
|
|---|
| 794 | 2.923688000 1.00000000
|
|---|
| 795 | })
|
|---|
| 796 | (type: [am = s]
|
|---|
| 797 | {exp coef:0} = {
|
|---|
| 798 | 0.650405000 1.00000000
|
|---|
| 799 | })
|
|---|
| 800 | (type: [am = s]
|
|---|
| 801 | {exp coef:0} = {
|
|---|
| 802 | 0.232825000 1.00000000
|
|---|
| 803 | })
|
|---|
| 804 | (type: [am = p]
|
|---|
| 805 | {exp coef:0} = {
|
|---|
| 806 | 663.062010000 0.00308200
|
|---|
| 807 | 157.092810000 0.02416500
|
|---|
| 808 | 50.231100000 0.10822300
|
|---|
| 809 | 18.635345000 0.29419200
|
|---|
| 810 | 7.446537000 0.68786200
|
|---|
| 811 | })
|
|---|
| 812 | (type: [am = p]
|
|---|
| 813 | {exp coef:0} = {
|
|---|
| 814 | 7.446537000 -0.12144820
|
|---|
| 815 | 3.095698000 0.16323700
|
|---|
| 816 | })
|
|---|
| 817 | (type: [am = p]
|
|---|
| 818 | {exp coef:0} = {
|
|---|
| 819 | 1.106463000 1.00000000
|
|---|
| 820 | })
|
|---|
| 821 | (type: [am = p]
|
|---|
| 822 | {exp coef:0} = {
|
|---|
| 823 | 0.415601000 1.00000000
|
|---|
| 824 | })
|
|---|
| 825 | (type: [am = p]
|
|---|
| 826 | {exp coef:0} = {
|
|---|
| 827 | 0.145449000 1.00000000
|
|---|
| 828 | })
|
|---|
| 829 | % AUGMENTING FUNCTIONS: (1d)
|
|---|
| 830 | (type: [(am = d puream = 1)]
|
|---|
| 831 | {exp coef:0} = {
|
|---|
| 832 | 0.85000000 1.00000000
|
|---|
| 833 | })
|
|---|
| 834 | ]
|
|---|
| 835 | %
|
|---|
| 836 | % BASIS SET: (14s,11p,3d) -> [8s,7p,1d]
|
|---|
| 837 | potassium: "6-311G**": [
|
|---|
| 838 | (type: [am = s]
|
|---|
| 839 | {exp coef:0} = {
|
|---|
| 840 | 182594.000000000 0.00022775
|
|---|
| 841 | 27369.000000000 0.00176640
|
|---|
| 842 | 6229.170000000 0.00919497
|
|---|
| 843 | 1764.580000000 0.03745510
|
|---|
| 844 | 577.051000000 0.12204500
|
|---|
| 845 | 210.249000000 0.29899000
|
|---|
| 846 | })
|
|---|
| 847 | (type: [am = s]
|
|---|
| 848 | {exp coef:0} = {
|
|---|
| 849 | 82.617800000 0.40514700
|
|---|
| 850 | 33.233200000 0.29253200
|
|---|
| 851 | })
|
|---|
| 852 | (type: [am = s]
|
|---|
| 853 | {exp coef:0} = {
|
|---|
| 854 | 8.106490000 1.00000000
|
|---|
| 855 | })
|
|---|
| 856 | (type: [am = s]
|
|---|
| 857 | {exp coef:0} = {
|
|---|
| 858 | 3.334030000 1.00000000
|
|---|
| 859 | })
|
|---|
| 860 | (type: [am = s]
|
|---|
| 861 | {exp coef:0} = {
|
|---|
| 862 | 0.845544000 1.00000000
|
|---|
| 863 | })
|
|---|
| 864 | (type: [am = s]
|
|---|
| 865 | {exp coef:0} = {
|
|---|
| 866 | 0.328216000 1.00000000
|
|---|
| 867 | })
|
|---|
| 868 | (type: [am = s]
|
|---|
| 869 | {exp coef:0} = {
|
|---|
| 870 | 0.036403500 1.00000000
|
|---|
| 871 | })
|
|---|
| 872 | (type: [am = s]
|
|---|
| 873 | {exp coef:0} = {
|
|---|
| 874 | 0.017646300 1.00000000
|
|---|
| 875 | })
|
|---|
| 876 | (type: [am = p]
|
|---|
| 877 | {exp coef:0} = {
|
|---|
| 878 | 891.054000000 0.00218429
|
|---|
| 879 | 211.016000000 0.01758910
|
|---|
| 880 | 67.671400000 0.08177750
|
|---|
| 881 | })
|
|---|
| 882 | (type: [am = p]
|
|---|
| 883 | {exp coef:0} = {
|
|---|
| 884 | 25.271500000 0.24565600
|
|---|
| 885 | 10.139000000 0.43398400
|
|---|
| 886 | 4.201860000 0.36237700
|
|---|
| 887 | })
|
|---|
| 888 | (type: [am = p]
|
|---|
| 889 | {exp coef:0} = {
|
|---|
| 890 | 1.625070000 1.00000000
|
|---|
| 891 | })
|
|---|
| 892 | (type: [am = p]
|
|---|
| 893 | {exp coef:0} = {
|
|---|
| 894 | 0.643770000 1.00000000
|
|---|
| 895 | })
|
|---|
| 896 | (type: [am = p]
|
|---|
| 897 | {exp coef:0} = {
|
|---|
| 898 | 0.246130000 1.00000000
|
|---|
| 899 | })
|
|---|
| 900 | (type: [am = p]
|
|---|
| 901 | {exp coef:0} = {
|
|---|
| 902 | 0.045440000 1.00000000
|
|---|
| 903 | })
|
|---|
| 904 | (type: [am = p]
|
|---|
| 905 | {exp coef:0} = {
|
|---|
| 906 | 0.016160000 1.00000000
|
|---|
| 907 | })
|
|---|
| 908 | (type: [(am = d puream = 1)]
|
|---|
| 909 | {exp coef:0} = {
|
|---|
| 910 | 13.370000000 0.03160160
|
|---|
| 911 | 3.421000000 0.15687900
|
|---|
| 912 | 1.063000000 0.39058200
|
|---|
| 913 | })
|
|---|
| 914 | % AUGMENTING FUNCTIONS: (1d)
|
|---|
| 915 | (type: [(am = d puream = 1)]
|
|---|
| 916 | {exp coef:0} = {
|
|---|
| 917 | 0.22900000 1.00000000
|
|---|
| 918 | })
|
|---|
| 919 | ]
|
|---|
| 920 | %
|
|---|
| 921 | % BASIS SET: (14s,11p,3d) -> [8s,7p,1d]
|
|---|
| 922 | calcium: "6-311G**": [
|
|---|
| 923 | (type: [am = s]
|
|---|
| 924 | {exp coef:0} = {
|
|---|
| 925 | 202699.000000000 0.00022296
|
|---|
| 926 | 30382.500000000 0.00172932
|
|---|
| 927 | 6915.080000000 0.00900226
|
|---|
| 928 | 1959.020000000 0.03666990
|
|---|
| 929 | 640.936000000 0.11941000
|
|---|
| 930 | 233.977000000 0.29182500
|
|---|
| 931 | })
|
|---|
| 932 | (type: [am = s]
|
|---|
| 933 | {exp coef:0} = {
|
|---|
| 934 | 92.289200000 0.40441500
|
|---|
| 935 | 37.254500000 0.29631300
|
|---|
| 936 | })
|
|---|
| 937 | (type: [am = s]
|
|---|
| 938 | {exp coef:0} = {
|
|---|
| 939 | 9.131980000 1.00000000
|
|---|
| 940 | })
|
|---|
| 941 | (type: [am = s]
|
|---|
| 942 | {exp coef:0} = {
|
|---|
| 943 | 3.817790000 1.00000000
|
|---|
| 944 | })
|
|---|
| 945 | (type: [am = s]
|
|---|
| 946 | {exp coef:0} = {
|
|---|
| 947 | 1.049350000 1.00000000
|
|---|
| 948 | })
|
|---|
| 949 | (type: [am = s]
|
|---|
| 950 | {exp coef:0} = {
|
|---|
| 951 | 0.428660000 1.00000000
|
|---|
| 952 | })
|
|---|
| 953 | (type: [am = s]
|
|---|
| 954 | {exp coef:0} = {
|
|---|
| 955 | 0.062822600 1.00000000
|
|---|
| 956 | })
|
|---|
| 957 | (type: [am = s]
|
|---|
| 958 | {exp coef:0} = {
|
|---|
| 959 | 0.026016200 1.00000000
|
|---|
| 960 | })
|
|---|
| 961 | (type: [am = p]
|
|---|
| 962 | {exp coef:0} = {
|
|---|
| 963 | 1019.760000000 0.00205986
|
|---|
| 964 | 241.596000000 0.01665010
|
|---|
| 965 | 77.637000000 0.07776460
|
|---|
| 966 | })
|
|---|
| 967 | (type: [am = p]
|
|---|
| 968 | {exp coef:0} = {
|
|---|
| 969 | 29.115400000 0.24180600
|
|---|
| 970 | 11.762600000 0.43257800
|
|---|
| 971 | 4.922890000 0.36732500
|
|---|
| 972 | })
|
|---|
| 973 | (type: [am = p]
|
|---|
| 974 | {exp coef:0} = {
|
|---|
| 975 | 1.906450000 1.00000000
|
|---|
| 976 | })
|
|---|
| 977 | (type: [am = p]
|
|---|
| 978 | {exp coef:0} = {
|
|---|
| 979 | 0.736900000 1.00000000
|
|---|
| 980 | })
|
|---|
| 981 | (type: [am = p]
|
|---|
| 982 | {exp coef:0} = {
|
|---|
| 983 | 0.276420000 1.00000000
|
|---|
| 984 | })
|
|---|
| 985 | (type: [am = p]
|
|---|
| 986 | {exp coef:0} = {
|
|---|
| 987 | 0.060270000 1.00000000
|
|---|
| 988 | })
|
|---|
| 989 | (type: [am = p]
|
|---|
| 990 | {exp coef:0} = {
|
|---|
| 991 | 0.017910000 1.00000000
|
|---|
| 992 | })
|
|---|
| 993 | (type: [(am = d puream = 1)]
|
|---|
| 994 | {exp coef:0} = {
|
|---|
| 995 | 15.080000000 0.03689470
|
|---|
| 996 | 3.926000000 0.17782000
|
|---|
| 997 | 1.233000000 0.42551300
|
|---|
| 998 | })
|
|---|
| 999 | % AUGMENTING FUNCTIONS: (1d)
|
|---|
| 1000 | (type: [(am = d puream = 1)]
|
|---|
| 1001 | {exp coef:0} = {
|
|---|
| 1002 | 0.26000000 1.00000000
|
|---|
| 1003 | })
|
|---|
| 1004 | ]
|
|---|
| 1005 | %
|
|---|
| 1006 | % BASIS SET: (14s,12p,5d) -> [8s,7p,2d]
|
|---|
| 1007 | gallium: "6-311G**": [
|
|---|
| 1008 | (type: [am = s]
|
|---|
| 1009 | {exp coef:0} = {
|
|---|
| 1010 | 333800.000000000 0.00083805
|
|---|
| 1011 | 50100.000000000 0.00624660
|
|---|
| 1012 | 11510.000000000 0.03202800
|
|---|
| 1013 | 3292.000000000 0.12709000
|
|---|
| 1014 | 1089.000000000 0.39092000
|
|---|
| 1015 | 401.000000000 0.54643000
|
|---|
| 1016 | })
|
|---|
| 1017 | (type: [am = s]
|
|---|
| 1018 | {exp coef:0} = {
|
|---|
| 1019 | 401.000000000 0.18078000
|
|---|
| 1020 | 159.300000000 0.62239000
|
|---|
| 1021 | 67.590000000 0.24953000
|
|---|
| 1022 | })
|
|---|
| 1023 | (type: [am = s]
|
|---|
| 1024 | {exp coef:0} = {
|
|---|
| 1025 | 24.890000000 1.00000000
|
|---|
| 1026 | })
|
|---|
| 1027 | (type: [am = s]
|
|---|
| 1028 | {exp coef:0} = {
|
|---|
| 1029 | 10.680000000 1.00000000
|
|---|
| 1030 | })
|
|---|
| 1031 | (type: [am = s]
|
|---|
| 1032 | {exp coef:0} = {
|
|---|
| 1033 | 3.386000000 1.00000000
|
|---|
| 1034 | })
|
|---|
| 1035 | (type: [am = s]
|
|---|
| 1036 | {exp coef:0} = {
|
|---|
| 1037 | 1.331000000 1.00000000
|
|---|
| 1038 | })
|
|---|
| 1039 | (type: [am = s]
|
|---|
| 1040 | {exp coef:0} = {
|
|---|
| 1041 | 0.185300000 1.00000000
|
|---|
| 1042 | })
|
|---|
| 1043 | (type: [am = s]
|
|---|
| 1044 | {exp coef:0} = {
|
|---|
| 1045 | 0.066210000 1.00000000
|
|---|
| 1046 | })
|
|---|
| 1047 | (type: [am = p]
|
|---|
| 1048 | {exp coef:0} = {
|
|---|
| 1049 | 2181.000000000 0.02256500
|
|---|
| 1050 | 515.400000000 0.18363000
|
|---|
| 1051 | 164.800000000 0.85984000
|
|---|
| 1052 | })
|
|---|
| 1053 | (type: [am = p]
|
|---|
| 1054 | {exp coef:0} = {
|
|---|
| 1055 | 61.400000000 0.34345000
|
|---|
| 1056 | 24.980000000 0.50561000
|
|---|
| 1057 | 10.440000000 0.26224000
|
|---|
| 1058 | })
|
|---|
| 1059 | (type: [am = p]
|
|---|
| 1060 | {exp coef:0} = {
|
|---|
| 1061 | 10.440000000 0.06413000
|
|---|
| 1062 | 5.589000000 0.37884000
|
|---|
| 1063 | 2.517000000 0.61669000
|
|---|
| 1064 | })
|
|---|
| 1065 | (type: [am = p]
|
|---|
| 1066 | {exp coef:0} = {
|
|---|
| 1067 | 1.053000000 1.00000000
|
|---|
| 1068 | })
|
|---|
| 1069 | (type: [am = p]
|
|---|
| 1070 | {exp coef:0} = {
|
|---|
| 1071 | 0.291500000 1.00000000
|
|---|
| 1072 | })
|
|---|
| 1073 | (type: [am = p]
|
|---|
| 1074 | {exp coef:0} = {
|
|---|
| 1075 | 0.121000000 1.00000000
|
|---|
| 1076 | })
|
|---|
| 1077 | (type: [am = p]
|
|---|
| 1078 | {exp coef:0} = {
|
|---|
| 1079 | 0.039900000 1.00000000
|
|---|
| 1080 | })
|
|---|
| 1081 | (type: [(am = d puream = 1)]
|
|---|
| 1082 | {exp coef:0} = {
|
|---|
| 1083 | 67.140000000 0.03095700
|
|---|
| 1084 | 18.940000000 0.17480000
|
|---|
| 1085 | 6.426000000 0.44346000
|
|---|
| 1086 | 2.190000000 0.56702000
|
|---|
| 1087 | })
|
|---|
| 1088 | (type: [(am = d puream = 1)]
|
|---|
| 1089 | {exp coef:0} = {
|
|---|
| 1090 | 0.672500000 1.00000000
|
|---|
| 1091 | })
|
|---|
| 1092 | % AUGMENTING FUNCTIONS: (1d)
|
|---|
| 1093 | (type: [(am = d puream = 1)]
|
|---|
| 1094 | {exp coef:0} = {
|
|---|
| 1095 | 0.16900000 1.00000000
|
|---|
| 1096 | })
|
|---|
| 1097 | ]
|
|---|
| 1098 | %
|
|---|
| 1099 | % BASIS SET: (14s,12p,5d) -> [8s,7p,2d]
|
|---|
| 1100 | germanium: "6-311G**": [
|
|---|
| 1101 | (type: [am = s]
|
|---|
| 1102 | {exp coef:0} = {
|
|---|
| 1103 | 357500.000000000 0.00083898
|
|---|
| 1104 | 53670.000000000 0.00626350
|
|---|
| 1105 | 12300.000000000 0.03203600
|
|---|
| 1106 | 3512.000000000 0.12751000
|
|---|
| 1107 | 1161.000000000 0.39165000
|
|---|
| 1108 | 428.000000000 0.54528000
|
|---|
| 1109 | })
|
|---|
| 1110 | (type: [am = s]
|
|---|
| 1111 | {exp coef:0} = {
|
|---|
| 1112 | 428.000000000 0.18160000
|
|---|
| 1113 | 170.000000000 0.62248000
|
|---|
| 1114 | 72.060000000 0.24872000
|
|---|
| 1115 | })
|
|---|
| 1116 | (type: [am = s]
|
|---|
| 1117 | {exp coef:0} = {
|
|---|
| 1118 | 26.690000000 1.00000000
|
|---|
| 1119 | })
|
|---|
| 1120 | (type: [am = s]
|
|---|
| 1121 | {exp coef:0} = {
|
|---|
| 1122 | 11.500000000 1.00000000
|
|---|
| 1123 | })
|
|---|
| 1124 | (type: [am = s]
|
|---|
| 1125 | {exp coef:0} = {
|
|---|
| 1126 | 3.742000000 1.00000000
|
|---|
| 1127 | })
|
|---|
| 1128 | (type: [am = s]
|
|---|
| 1129 | {exp coef:0} = {
|
|---|
| 1130 | 1.499000000 1.00000000
|
|---|
| 1131 | })
|
|---|
| 1132 | (type: [am = s]
|
|---|
| 1133 | {exp coef:0} = {
|
|---|
| 1134 | 0.229200000 1.00000000
|
|---|
| 1135 | })
|
|---|
| 1136 | (type: [am = s]
|
|---|
| 1137 | {exp coef:0} = {
|
|---|
| 1138 | 0.086750000 1.00000000
|
|---|
| 1139 | })
|
|---|
| 1140 | (type: [am = p]
|
|---|
| 1141 | {exp coef:0} = {
|
|---|
| 1142 | 2345.000000000 0.02251400
|
|---|
| 1143 | 554.200000000 0.18335000
|
|---|
| 1144 | 177.300000000 0.86003000
|
|---|
| 1145 | })
|
|---|
| 1146 | (type: [am = p]
|
|---|
| 1147 | {exp coef:0} = {
|
|---|
| 1148 | 66.130000000 0.34306000
|
|---|
| 1149 | 26.900000000 0.50652000
|
|---|
| 1150 | 11.260000000 0.26141000
|
|---|
| 1151 | })
|
|---|
| 1152 | (type: [am = p]
|
|---|
| 1153 | {exp coef:0} = {
|
|---|
| 1154 | 11.260000000 0.06724600
|
|---|
| 1155 | 6.116000000 0.37238000
|
|---|
| 1156 | 2.819000000 0.61763000
|
|---|
| 1157 | })
|
|---|
| 1158 | (type: [am = p]
|
|---|
| 1159 | {exp coef:0} = {
|
|---|
| 1160 | 1.211000000 1.00000000
|
|---|
| 1161 | })
|
|---|
| 1162 | (type: [am = p]
|
|---|
| 1163 | {exp coef:0} = {
|
|---|
| 1164 | 0.356800000 1.00000000
|
|---|
| 1165 | })
|
|---|
| 1166 | (type: [am = p]
|
|---|
| 1167 | {exp coef:0} = {
|
|---|
| 1168 | 0.162100000 1.00000000
|
|---|
| 1169 | })
|
|---|
| 1170 | (type: [am = p]
|
|---|
| 1171 | {exp coef:0} = {
|
|---|
| 1172 | 0.060840000 1.00000000
|
|---|
| 1173 | })
|
|---|
| 1174 | (type: [(am = d puream = 1)]
|
|---|
| 1175 | {exp coef:0} = {
|
|---|
| 1176 | 74.840000000 0.03039000
|
|---|
| 1177 | 21.230000000 0.17319000
|
|---|
| 1178 | 7.297000000 0.44090000
|
|---|
| 1179 | 2.549000000 0.56532000
|
|---|
| 1180 | })
|
|---|
| 1181 | (type: [(am = d puream = 1)]
|
|---|
| 1182 | {exp coef:0} = {
|
|---|
| 1183 | 0.816500000 1.00000000
|
|---|
| 1184 | })
|
|---|
| 1185 | % AUGMENTING FUNCTIONS: (1d)
|
|---|
| 1186 | (type: [(am = d puream = 1)]
|
|---|
| 1187 | {exp coef:0} = {
|
|---|
| 1188 | 0.22800000 1.00000000
|
|---|
| 1189 | })
|
|---|
| 1190 | ]
|
|---|
| 1191 | %
|
|---|
| 1192 | % BASIS SET: (14s,12p,5d) -> [8s,7p,2d]
|
|---|
| 1193 | arsenic: "6-311G**": [
|
|---|
| 1194 | (type: [am = s]
|
|---|
| 1195 | {exp coef:0} = {
|
|---|
| 1196 | 381200.000000000 0.00083327
|
|---|
| 1197 | 57240.000000000 0.00621980
|
|---|
| 1198 | 13110.000000000 0.03203000
|
|---|
| 1199 | 3743.000000000 0.12729000
|
|---|
| 1200 | 1238.000000000 0.39132000
|
|---|
| 1201 | 456.300000000 0.54581000
|
|---|
| 1202 | })
|
|---|
| 1203 | (type: [am = s]
|
|---|
| 1204 | {exp coef:0} = {
|
|---|
| 1205 | 456.300000000 0.18097000
|
|---|
| 1206 | 181.400000000 0.62180000
|
|---|
| 1207 | 77.070000000 0.24988000
|
|---|
| 1208 | })
|
|---|
| 1209 | (type: [am = s]
|
|---|
| 1210 | {exp coef:0} = {
|
|---|
| 1211 | 28.570000000 1.00000000
|
|---|
| 1212 | })
|
|---|
| 1213 | (type: [am = s]
|
|---|
| 1214 | {exp coef:0} = {
|
|---|
| 1215 | 12.360000000 1.00000000
|
|---|
| 1216 | })
|
|---|
| 1217 | (type: [am = s]
|
|---|
| 1218 | {exp coef:0} = {
|
|---|
| 1219 | 4.117000000 1.00000000
|
|---|
| 1220 | })
|
|---|
| 1221 | (type: [am = s]
|
|---|
| 1222 | {exp coef:0} = {
|
|---|
| 1223 | 1.678000000 1.00000000
|
|---|
| 1224 | })
|
|---|
| 1225 | (type: [am = s]
|
|---|
| 1226 | {exp coef:0} = {
|
|---|
| 1227 | 0.276100000 1.00000000
|
|---|
| 1228 | })
|
|---|
| 1229 | (type: [am = s]
|
|---|
| 1230 | {exp coef:0} = {
|
|---|
| 1231 | 0.110500000 1.00000000
|
|---|
| 1232 | })
|
|---|
| 1233 | (type: [am = p]
|
|---|
| 1234 | {exp coef:0} = {
|
|---|
| 1235 | 2528.000000000 0.02227100
|
|---|
| 1236 | 597.300000000 0.18199000
|
|---|
| 1237 | 190.700000000 0.86133000
|
|---|
| 1238 | })
|
|---|
| 1239 | (type: [am = p]
|
|---|
| 1240 | {exp coef:0} = {
|
|---|
| 1241 | 70.960000000 0.34338000
|
|---|
| 1242 | 28.890000000 0.50598000
|
|---|
| 1243 | 12.130000000 0.26128000
|
|---|
| 1244 | })
|
|---|
| 1245 | (type: [am = p]
|
|---|
| 1246 | {exp coef:0} = {
|
|---|
| 1247 | 12.130000000 0.06853600
|
|---|
| 1248 | 6.533000000 0.38282000
|
|---|
| 1249 | 3.028000000 0.60599000
|
|---|
| 1250 | })
|
|---|
| 1251 | (type: [am = p]
|
|---|
| 1252 | {exp coef:0} = {
|
|---|
| 1253 | 1.344000000 1.00000000
|
|---|
| 1254 | })
|
|---|
| 1255 | (type: [am = p]
|
|---|
| 1256 | {exp coef:0} = {
|
|---|
| 1257 | 0.582300000 1.00000000
|
|---|
| 1258 | })
|
|---|
| 1259 | (type: [am = p]
|
|---|
| 1260 | {exp coef:0} = {
|
|---|
| 1261 | 0.255800000 1.00000000
|
|---|
| 1262 | })
|
|---|
| 1263 | (type: [am = p]
|
|---|
| 1264 | {exp coef:0} = {
|
|---|
| 1265 | 0.086510000 1.00000000
|
|---|
| 1266 | })
|
|---|
| 1267 | (type: [(am = d puream = 1)]
|
|---|
| 1268 | {exp coef:0} = {
|
|---|
| 1269 | 86.050000000 0.02798900
|
|---|
| 1270 | 24.490000000 0.16502000
|
|---|
| 1271 | 8.442000000 0.43736000
|
|---|
| 1272 | 2.981000000 0.57255000
|
|---|
| 1273 | })
|
|---|
| 1274 | (type: [(am = d puream = 1)]
|
|---|
| 1275 | {exp coef:0} = {
|
|---|
| 1276 | 0.979000000 1.00000000
|
|---|
| 1277 | })
|
|---|
| 1278 | % AUGMENTING FUNCTIONS: (1d)
|
|---|
| 1279 | (type: [(am = d puream = 1)]
|
|---|
| 1280 | {exp coef:0} = {
|
|---|
| 1281 | 0.26400000 1.00000000
|
|---|
| 1282 | })
|
|---|
| 1283 | ]
|
|---|
| 1284 | %
|
|---|
| 1285 | % BASIS SET: (14s,12p,5d) -> [8s,7p,2d]
|
|---|
| 1286 | selenium: "6-311G**": [
|
|---|
| 1287 | (type: [am = s]
|
|---|
| 1288 | {exp coef:0} = {
|
|---|
| 1289 | 405400.000000000 0.00083100
|
|---|
| 1290 | 60850.000000000 0.00623310
|
|---|
| 1291 | 13910.000000000 0.03207100
|
|---|
| 1292 | 3989.000000000 0.12636000
|
|---|
| 1293 | 1324.000000000 0.38899000
|
|---|
| 1294 | 487.000000000 0.54888000
|
|---|
| 1295 | })
|
|---|
| 1296 | (type: [am = s]
|
|---|
| 1297 | {exp coef:0} = {
|
|---|
| 1298 | 487.000000000 0.17963000
|
|---|
| 1299 | 193.200000000 0.62227000
|
|---|
| 1300 | 82.190000000 0.25067000
|
|---|
| 1301 | })
|
|---|
| 1302 | (type: [am = s]
|
|---|
| 1303 | {exp coef:0} = {
|
|---|
| 1304 | 30.520000000 1.00000000
|
|---|
| 1305 | })
|
|---|
| 1306 | (type: [am = s]
|
|---|
| 1307 | {exp coef:0} = {
|
|---|
| 1308 | 13.250000000 1.00000000
|
|---|
| 1309 | })
|
|---|
| 1310 | (type: [am = s]
|
|---|
| 1311 | {exp coef:0} = {
|
|---|
| 1312 | 4.510000000 1.00000000
|
|---|
| 1313 | })
|
|---|
| 1314 | (type: [am = s]
|
|---|
| 1315 | {exp coef:0} = {
|
|---|
| 1316 | 1.867000000 1.00000000
|
|---|
| 1317 | })
|
|---|
| 1318 | (type: [am = s]
|
|---|
| 1319 | {exp coef:0} = {
|
|---|
| 1320 | 0.319000000 1.00000000
|
|---|
| 1321 | })
|
|---|
| 1322 | (type: [am = s]
|
|---|
| 1323 | {exp coef:0} = {
|
|---|
| 1324 | 0.112000000 1.00000000
|
|---|
| 1325 | })
|
|---|
| 1326 | (type: [am = p]
|
|---|
| 1327 | {exp coef:0} = {
|
|---|
| 1328 | 2706.000000000 0.02214600
|
|---|
| 1329 | 638.600000000 0.18180000
|
|---|
| 1330 | 203.800000000 0.86155000
|
|---|
| 1331 | })
|
|---|
| 1332 | (type: [am = p]
|
|---|
| 1333 | {exp coef:0} = {
|
|---|
| 1334 | 75.960000000 0.34243000
|
|---|
| 1335 | 31.020000000 0.50541000
|
|---|
| 1336 | 13.050000000 0.26237000
|
|---|
| 1337 | })
|
|---|
| 1338 | (type: [am = p]
|
|---|
| 1339 | {exp coef:0} = {
|
|---|
| 1340 | 13.050000000 0.07016300
|
|---|
| 1341 | 6.986000000 0.38419000
|
|---|
| 1342 | 3.234000000 0.60368000
|
|---|
| 1343 | })
|
|---|
| 1344 | (type: [am = p]
|
|---|
| 1345 | {exp coef:0} = {
|
|---|
| 1346 | 1.475000000 1.00000000
|
|---|
| 1347 | })
|
|---|
| 1348 | (type: [am = p]
|
|---|
| 1349 | {exp coef:0} = {
|
|---|
| 1350 | 0.727500000 1.00000000
|
|---|
| 1351 | })
|
|---|
| 1352 | (type: [am = p]
|
|---|
| 1353 | {exp coef:0} = {
|
|---|
| 1354 | 0.286900000 1.00000000
|
|---|
| 1355 | })
|
|---|
| 1356 | (type: [am = p]
|
|---|
| 1357 | {exp coef:0} = {
|
|---|
| 1358 | 0.096790000 1.00000000
|
|---|
| 1359 | })
|
|---|
| 1360 | (type: [(am = d puream = 1)]
|
|---|
| 1361 | {exp coef:0} = {
|
|---|
| 1362 | 99.010000000 0.02559600
|
|---|
| 1363 | 28.410000000 0.15459000
|
|---|
| 1364 | 9.863000000 0.42878000
|
|---|
| 1365 | 3.514000000 0.58620000
|
|---|
| 1366 | })
|
|---|
| 1367 | (type: [(am = d puream = 1)]
|
|---|
| 1368 | {exp coef:0} = {
|
|---|
| 1369 | 1.171000000 1.00000000
|
|---|
| 1370 | })
|
|---|
| 1371 | % AUGMENTING FUNCTIONS: (1d)
|
|---|
| 1372 | (type: [(am = d puream = 1)]
|
|---|
| 1373 | {exp coef:0} = {
|
|---|
| 1374 | 0.30500000 1.00000000
|
|---|
| 1375 | })
|
|---|
| 1376 | ]
|
|---|
| 1377 | %
|
|---|
| 1378 | % BASIS SET: (14s,12p,5d) -> [8s,7p,2d]
|
|---|
| 1379 | bromine: "6-311G**": [
|
|---|
| 1380 | (type: [am = s]
|
|---|
| 1381 | {exp coef:0} = {
|
|---|
| 1382 | 439700.000000000 0.00081300
|
|---|
| 1383 | 66030.000000000 0.00628500
|
|---|
| 1384 | 15140.000000000 0.03192000
|
|---|
| 1385 | 4317.000000000 0.12880000
|
|---|
| 1386 | 1414.000000000 0.39460000
|
|---|
| 1387 | 523.900000000 0.54130000
|
|---|
| 1388 | })
|
|---|
| 1389 | (type: [am = s]
|
|---|
| 1390 | {exp coef:0} = {
|
|---|
| 1391 | 523.900000000 0.18310000
|
|---|
| 1392 | 207.700000000 0.61760000
|
|---|
| 1393 | 86.540000000 0.25380000
|
|---|
| 1394 | })
|
|---|
| 1395 | (type: [am = s]
|
|---|
| 1396 | {exp coef:0} = {
|
|---|
| 1397 | 30.520000000 1.00000000
|
|---|
| 1398 | })
|
|---|
| 1399 | (type: [am = s]
|
|---|
| 1400 | {exp coef:0} = {
|
|---|
| 1401 | 12.980000000 1.00000000
|
|---|
| 1402 | })
|
|---|
| 1403 | (type: [am = s]
|
|---|
| 1404 | {exp coef:0} = {
|
|---|
| 1405 | 4.412000000 1.00000000
|
|---|
| 1406 | })
|
|---|
| 1407 | (type: [am = s]
|
|---|
| 1408 | {exp coef:0} = {
|
|---|
| 1409 | 1.862000000 1.00000000
|
|---|
| 1410 | })
|
|---|
| 1411 | (type: [am = s]
|
|---|
| 1412 | {exp coef:0} = {
|
|---|
| 1413 | 0.393200000 1.00000000
|
|---|
| 1414 | })
|
|---|
| 1415 | (type: [am = s]
|
|---|
| 1416 | {exp coef:0} = {
|
|---|
| 1417 | 0.140000000 1.00000000
|
|---|
| 1418 | })
|
|---|
| 1419 | (type: [am = p]
|
|---|
| 1420 | {exp coef:0} = {
|
|---|
| 1421 | 2957.000000000 0.02226000
|
|---|
| 1422 | 700.300000000 0.18020000
|
|---|
| 1423 | 224.600000000 0.86240000
|
|---|
| 1424 | })
|
|---|
| 1425 | (type: [am = p]
|
|---|
| 1426 | {exp coef:0} = {
|
|---|
| 1427 | 82.590000000 0.34400000
|
|---|
| 1428 | 33.190000000 0.50710000
|
|---|
| 1429 | 14.200000000 0.25900000
|
|---|
| 1430 | })
|
|---|
| 1431 | (type: [am = p]
|
|---|
| 1432 | {exp coef:0} = {
|
|---|
| 1433 | 14.200000000 0.07965000
|
|---|
| 1434 | 7.438000000 0.37340000
|
|---|
| 1435 | 3.526000000 0.60490000
|
|---|
| 1436 | })
|
|---|
| 1437 | (type: [am = p]
|
|---|
| 1438 | {exp coef:0} = {
|
|---|
| 1439 | 1.595000000 1.00000000
|
|---|
| 1440 | })
|
|---|
| 1441 | (type: [am = p]
|
|---|
| 1442 | {exp coef:0} = {
|
|---|
| 1443 | 0.846200000 1.00000000
|
|---|
| 1444 | })
|
|---|
| 1445 | (type: [am = p]
|
|---|
| 1446 | {exp coef:0} = {
|
|---|
| 1447 | 0.318600000 1.00000000
|
|---|
| 1448 | })
|
|---|
| 1449 | (type: [am = p]
|
|---|
| 1450 | {exp coef:0} = {
|
|---|
| 1451 | 0.109600000 1.00000000
|
|---|
| 1452 | })
|
|---|
| 1453 | (type: [(am = d puream = 1)]
|
|---|
| 1454 | {exp coef:0} = {
|
|---|
| 1455 | 134.800000000 0.01831000
|
|---|
| 1456 | 36.390000000 0.13500000
|
|---|
| 1457 | 12.160000000 0.42610000
|
|---|
| 1458 | 4.341000000 0.60430000
|
|---|
| 1459 | })
|
|---|
| 1460 | (type: [(am = d puream = 1)]
|
|---|
| 1461 | {exp coef:0} = {
|
|---|
| 1462 | 1.535000000 1.00000000
|
|---|
| 1463 | })
|
|---|
| 1464 | % AUGMENTING FUNCTIONS: (1d)
|
|---|
| 1465 | (type: [(am = d puream = 1)]
|
|---|
| 1466 | {exp coef:0} = {
|
|---|
| 1467 | 0.45100000 1.00000000
|
|---|
| 1468 | })
|
|---|
| 1469 | ]
|
|---|
| 1470 | %
|
|---|
| 1471 | % BASIS SET: (14s,12p,5d) -> [8s,7p,2d]
|
|---|
| 1472 | krypton: "6-311G**": [
|
|---|
| 1473 | (type: [am = s]
|
|---|
| 1474 | {exp coef:0} = {
|
|---|
| 1475 | 456200.000000000 0.00081110
|
|---|
| 1476 | 68460.000000000 0.00625520
|
|---|
| 1477 | 15650.000000000 0.03202200
|
|---|
| 1478 | 4500.000000000 0.12546000
|
|---|
| 1479 | 1497.000000000 0.38666000
|
|---|
| 1480 | 550.500000000 0.55188000
|
|---|
| 1481 | })
|
|---|
| 1482 | (type: [am = s]
|
|---|
| 1483 | {exp coef:0} = {
|
|---|
| 1484 | 550.500000000 0.17711000
|
|---|
| 1485 | 218.200000000 0.62248000
|
|---|
| 1486 | 92.970000000 0.25279000
|
|---|
| 1487 | })
|
|---|
| 1488 | (type: [am = s]
|
|---|
| 1489 | {exp coef:0} = {
|
|---|
| 1490 | 34.590000000 1.00000000
|
|---|
| 1491 | })
|
|---|
| 1492 | (type: [am = s]
|
|---|
| 1493 | {exp coef:0} = {
|
|---|
| 1494 | 15.120000000 1.00000000
|
|---|
| 1495 | })
|
|---|
| 1496 | (type: [am = s]
|
|---|
| 1497 | {exp coef:0} = {
|
|---|
| 1498 | 5.346000000 1.00000000
|
|---|
| 1499 | })
|
|---|
| 1500 | (type: [am = s]
|
|---|
| 1501 | {exp coef:0} = {
|
|---|
| 1502 | 2.273000000 1.00000000
|
|---|
| 1503 | })
|
|---|
| 1504 | (type: [am = s]
|
|---|
| 1505 | {exp coef:0} = {
|
|---|
| 1506 | 0.484100000 1.00000000
|
|---|
| 1507 | })
|
|---|
| 1508 | (type: [am = s]
|
|---|
| 1509 | {exp coef:0} = {
|
|---|
| 1510 | 0.184900000 1.00000000
|
|---|
| 1511 | })
|
|---|
| 1512 | (type: [am = p]
|
|---|
| 1513 | {exp coef:0} = {
|
|---|
| 1514 | 3074.000000000 0.02199800
|
|---|
| 1515 | 725.700000000 0.18102000
|
|---|
| 1516 | 231.500000000 0.86223000
|
|---|
| 1517 | })
|
|---|
| 1518 | (type: [am = p]
|
|---|
| 1519 | {exp coef:0} = {
|
|---|
| 1520 | 86.450000000 0.34155000
|
|---|
| 1521 | 35.550000000 0.50255000
|
|---|
| 1522 | 15.140000000 0.26453000
|
|---|
| 1523 | })
|
|---|
| 1524 | (type: [am = p]
|
|---|
| 1525 | {exp coef:0} = {
|
|---|
| 1526 | 15.140000000 0.07167000
|
|---|
| 1527 | 8.031000000 0.39708000
|
|---|
| 1528 | 3.799000000 0.58762000
|
|---|
| 1529 | })
|
|---|
| 1530 | (type: [am = p]
|
|---|
| 1531 | {exp coef:0} = {
|
|---|
| 1532 | 1.849000000 1.00000000
|
|---|
| 1533 | })
|
|---|
| 1534 | (type: [am = p]
|
|---|
| 1535 | {exp coef:0} = {
|
|---|
| 1536 | 0.867600000 1.00000000
|
|---|
| 1537 | })
|
|---|
| 1538 | (type: [am = p]
|
|---|
| 1539 | {exp coef:0} = {
|
|---|
| 1540 | 0.332900000 1.00000000
|
|---|
| 1541 | })
|
|---|
| 1542 | (type: [am = p]
|
|---|
| 1543 | {exp coef:0} = {
|
|---|
| 1544 | 0.119900000 1.00000000
|
|---|
| 1545 | })
|
|---|
| 1546 | (type: [(am = d puream = 1)]
|
|---|
| 1547 | {exp coef:0} = {
|
|---|
| 1548 | 122.500000000 0.02337700
|
|---|
| 1549 | 35.370000000 0.14610000
|
|---|
| 1550 | 12.390000000 0.42230000
|
|---|
| 1551 | 4.496000000 0.59452000
|
|---|
| 1552 | })
|
|---|
| 1553 | (type: [(am = d puream = 1)]
|
|---|
| 1554 | {exp coef:0} = {
|
|---|
| 1555 | 1.546000000 1.00000000
|
|---|
| 1556 | })
|
|---|
| 1557 | % AUGMENTING FUNCTIONS: (1d)
|
|---|
| 1558 | (type: [(am = d puream = 1)]
|
|---|
| 1559 | {exp coef:0} = {
|
|---|
| 1560 | 0.39500000 1.00000000
|
|---|
| 1561 | })
|
|---|
| 1562 | ]
|
|---|
| 1563 | )
|
|---|
