/usr/share/cp2k/DFTB/nonscc/ss is in cp2k-data 5.1-3.
This file is owned by root:root, with mode 0o644.
The actual contents of the file can be viewed below.
1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 81 82 83 84 85 86 87 88 89 90 91 92 93 94 95 96 97 98 99 100 101 102 103 104 105 106 107 108 109 110 111 112 113 114 115 116 117 118 119 120 121 122 123 124 125 126 127 128 129 130 131 132 133 134 135 136 137 138 139 140 141 142 | 0.1, 140,
0.0, -0.2565, -0.6294, 0.0 3*0.0 0.0 4.0 2.0 T F
32.064, 0.3537040485 -0.3233001583 0.1826066293 5*0.0, 4.0, 4.0, 0.0, 4.0, 2.0, 6*0.0,
20*0.0,
20*0.0,
20*0.0,
5*0.0 -0.31408 -1.39733 0.0 -0.52608 -1.74200 5*0.0 0.84988 0.94162 0.0 0.16757 0.92557
5*0.0 -0.20578 -1.16681 0.0 -0.58775 -1.60237 5*0.0 0.79821 0.91809 0.0 0.20129 0.89622
5*0.0 -0.22879 -1.00739 0.0 -0.54110 -1.42979 5*0.0 0.74719 0.89386 0.0 0.22927 0.86410
5*0.0 -0.30080 -0.90109 0.0 -0.45253 -1.25204 5*0.0 0.69577 0.86925 0.0 0.25302 0.83072
5*0.0 -0.37152 -0.83065 0.0 -0.36575 -1.09409 5*0.0 0.64246 0.84426 0.0 0.27431 0.79763
5*0.0 -0.41651 -0.78243 0.0 -0.30240 -0.96840 5*0.0 0.58609 0.81873 0.0 0.29458 0.76602
5*0.0 -0.42808 -0.74670 0.0 -0.26894 -0.87690 5*0.0 0.52611 0.79250 0.0 0.31474 0.73657
5*0.0 -0.40787 -0.71704 0.0 -0.26329 -0.81535 5*0.0 0.46256 0.76542 0.0 0.33517 0.70952
5*0.0 -0.36185 -0.68951 0.0 -0.27944 -0.77690 5*0.0 0.39597 0.73743 0.0 0.35582 0.68473
5*0.0 -0.29741 -0.66192 0.0 -0.31034 -0.75433 5*0.0 0.32720 0.70853 0.0 0.37635 0.66183
5*0.0 -0.22176 -0.63323 0.0 -0.34937 -0.74128 5*0.0 0.25732 0.67880 0.0 0.39625 0.64036
5*0.0 -0.14113 -0.60312 0.0 -0.39105 -0.73268 5*0.0 0.18744 0.64837 0.0 0.41496 0.61982
5*0.0 -0.06051 -0.57172 0.0 -0.43125 -0.72486 5*0.0 0.11867 0.61740 0.0 0.43195 0.59975
5*0.0 0.01641 -0.53936 0.0 -0.46711 -0.71541 5*0.0 0.05204 0.58609 0.0 0.44672 0.57978
5*0.0 0.08713 -0.50648 0.0 -0.49688 -0.70294 5*0.0 -0.01153 0.55464 0.0 0.45891 0.55960
5*0.0 0.15010 -0.47355 0.0 -0.51967 -0.68682 5*0.0 -0.07127 0.52325 0.0 0.46823 0.53903
5*0.0 0.20454 -0.44097 0.0 -0.53527 -0.66699 5*0.0 -0.12655 0.49212 0.0 0.47451 0.51795
5*0.0 0.25027 -0.40911 0.0 -0.54390 -0.64371 5*0.0 -0.17689 0.46144 0.0 0.47768 0.49632
5*0.0 0.28751 -0.37826 0.0 -0.54608 -0.61748 5*0.0 -0.22194 0.43138 0.0 0.47777 0.47419
5*0.0 0.31676 -0.34865 0.0 -0.54252 -0.58891 5*0.0 -0.26153 0.40210 0.0 0.47487 0.45162
5*0.0 0.33866 -0.32044 0.0 -0.53399 -0.55861 5*0.0 -0.29558 0.37372 0.0 0.46914 0.42873
5*0.0 0.35398 -0.29375 0.0 -0.52128 -0.52717 5*0.0 -0.32413 0.34636 0.0 0.46081 0.40566
5*0.0 0.36350 -0.26864 0.0 -0.50517 -0.49516 5*0.0 -0.34732 0.32011 0.0 0.45013 0.38254
5*0.0 0.36797 -0.24513 0.0 -0.48637 -0.46306 5*0.0 -0.36538 0.29504 0.0 0.43736 0.35952
5*0.0 0.36815 -0.22322 0.0 -0.46553 -0.43127 5*0.0 -0.37858 0.27120 0.0 0.42279 0.33677
5*0.0 0.36470 -0.20287 0.0 -0.44323 -0.40014 5*0.0 -0.38726 0.24863 0.0 0.40673 0.31441
5*0.0 0.35826 -0.18405 0.0 -0.41997 -0.36994 5*0.0 -0.39178 0.22735 0.0 0.38946 0.29257
5*0.0 0.34939 -0.16670 0.0 -0.39618 -0.34088 5*0.0 -0.39253 0.20736 0.0 0.37125 0.27136
5*0.0 0.33858 -0.15073 0.0 -0.37223 -0.31312 5*0.0 -0.38993 0.18864 0.0 0.35238 0.25088
5*0.0 0.32628 -0.13609 0.0 -0.34843 -0.28677 5*0.0 -0.38435 0.17119 0.0 0.33309 0.23122
5*0.0 0.31285 -0.12269 0.0 -0.32501 -0.26190 5*0.0 -0.37622 0.15496 0.0 0.31359 0.21243
5*0.0 0.29864 -0.11044 0.0 -0.30218 -0.23855 5*0.0 -0.36591 0.13993 0.0 0.29411 0.19456
5*0.0 0.28391 -0.09928 0.0 -0.28010 -0.21672 5*0.0 -0.35378 0.12604 0.0 0.27480 0.17765
5*0.0 0.26891 -0.08913 0.0 -0.25888 -0.19640 5*0.0 -0.34018 0.11325 0.0 0.25583 0.16172
5*0.0 0.25384 -0.07991 0.0 -0.23862 -0.17757 5*0.0 -0.32543 0.10151 0.0 0.23733 0.14677
5*0.0 0.23885 -0.07154 0.0 -0.21936 -0.16016 5*0.0 -0.30983 0.09076 0.0 0.21941 0.13280
5*0.0 0.22409 -0.06397 0.0 -0.20116 -0.14414 5*0.0 -0.29363 0.08095 0.0 0.20215 0.11980
5*0.0 0.20966 -0.05712 0.0 -0.18402 -0.12944 5*0.0 -0.27708 0.07202 0.0 0.18564 0.10774
5*0.0 0.19565 -0.05093 0.0 -0.16795 -0.11598 5*0.0 -0.26039 0.06390 0.0 0.16992 0.09661
5*0.0 0.18213 -0.04536 0.0 -0.15294 -0.10370 5*0.0 -0.24373 0.05655 0.0 0.15502 0.08636
5*0.0 0.16914 -0.04033 0.0 -0.13896 -0.09253 5*0.0 -0.22728 0.04992 0.0 0.14098 0.07695
5*0.0 0.15672 -0.03582 0.0 -0.12598 -0.08238 5*0.0 -0.21115 0.04394 0.0 0.12779 0.06836
5*0.0 0.14490 -0.03176 0.0 -0.11397 -0.07319 5*0.0 -0.19547 0.03856 0.0 0.11547 0.06052
5*0.0 0.13368 -0.02812 0.0 -0.10289 -0.06489 5*0.0 -0.18032 0.03375 0.0 0.10400 0.05341
5*0.0 0.12308 -0.02487 0.0 -0.09269 -0.05740 5*0.0 -0.16578 0.02944 0.0 0.09336 0.04697
5*0.0 0.11309 -0.02195 0.0 -0.08333 -0.05067 5*0.0 -0.15190 0.02560 0.0 0.08354 0.04115
5*0.0 0.10371 -0.01934 0.0 -0.07475 -0.04463 5*0.0 -0.13872 0.02218 0.0 0.07449 0.03592
5*0.0 0.09492 -0.01702 0.0 -0.06691 -0.03921 5*0.0 -0.12626 0.01915 0.0 0.06619 0.03123
5*0.0 0.08671 -0.01494 0.0 -0.05977 -0.03438 5*0.0 -0.11454 0.01647 0.0 0.05861 0.02704
5*0.0 0.07905 -0.01310 0.0 -0.05327 -0.03006 5*0.0 -0.10356 0.01410 0.0 0.05170 0.02330
5*0.0 0.07193 -0.01146 0.0 -0.04737 -0.02622 5*0.0 -0.09332 0.01202 0.0 0.04543 0.01999
5*0.0 0.06533 -0.01000 0.0 -0.04203 -0.02281 5*0.0 -0.08381 0.01019 0.0 0.03975 0.01705
5*0.0 0.05921 -0.00871 0.0 -0.03720 -0.01978 5*0.0 -0.07501 0.00859 0.0 0.03463 0.01446
5*0.0 0.05357 -0.00757 0.0 -0.03284 -0.01710 5*0.0 -0.06690 0.00720 0.0 0.03003 0.01218
5*0.0 0.04836 -0.00656 0.0 -0.02892 -0.01474 5*0.0 -0.05944 0.00598 0.0 0.02591 0.01018
5*0.0 0.04357 -0.00567 0.0 -0.02540 -0.01266 5*0.0 -0.05261 0.00493 0.0 0.02223 0.00844
5*0.0 0.03917 -0.00489 0.0 -0.02224 -0.01083 5*0.0 -0.04639 0.00403 0.0 0.01895 0.00692
5*0.0 0.03514 -0.00420 0.0 -0.01941 -0.00923 5*0.0 -0.04072 0.00325 0.0 0.01605 0.00561
5*0.0 0.03146 -0.00360 0.0 -0.01689 -0.00783 5*0.0 -0.03559 0.00258 0.0 0.01349 0.00448
5*0.0 0.02809 -0.00307 0.0 -0.01465 -0.00661 5*0.0 -0.03096 0.00201 0.0 0.01123 0.00351
5*0.0 0.02503 -0.00261 0.0 -0.01265 -0.00554 5*0.0 -0.02679 0.00153 0.0 0.00925 0.00268
5*0.0 0.02224 -0.00220 0.0 -0.01088 -0.00462 5*0.0 -0.02305 0.00112 0.0 0.00752 0.00198
5*0.0 0.01972 -0.00185 0.0 -0.00932 -0.00382 5*0.0 -0.01970 0.00078 0.0 0.00602 0.00139
5*0.0 0.01743 -0.00155 0.0 -0.00794 -0.00313 5*0.0 -0.01672 0.00050 0.0 0.00473 0.00090
5*0.0 0.01536 -0.00128 0.0 -0.00672 -0.00254 5*0.0 -0.01408 0.00027 0.0 0.00361 0.00048
5*0.0 0.01350 -0.00106 0.0 -0.00566 -0.00203 5*0.0 -0.01175 0.00008 0.0 0.00266 0.00015
5*0.0 0.01182 -0.00086 0.0 -0.00472 -0.00160 5*0.0 -0.00969 -0.00008 0.0 0.00184 -0.00013
5*0.0 0.01031 -0.00069 0.0 -0.00391 -0.00124 5*0.0 -0.00789 -0.00020 0.0 0.00116 -0.00035
5*0.0 0.00896 -0.00055 0.0 -0.00320 -0.00093 5*0.0 -0.00632 -0.00030 0.0 0.00059 -0.00052
5*0.0 0.00776 -0.00043 0.0 -0.00259 -0.00067 5*0.0 -0.00495 -0.00037 0.0 0.00011 -0.00065
5*0.0 0.00668 -0.00032 0.0 -0.00206 -0.00045 5*0.0 -0.00377 -0.00042 0.0 -0.00028 -0.00075
5*0.0 0.00573 -0.00024 0.0 -0.00161 -0.00027 5*0.0 -0.00276 -0.00046 0.0 -0.00060 -0.00082
5*0.0 0.00488 -0.00016 0.0 -0.00122 -0.00012 5*0.0 -0.00189 -0.00048 0.0 -0.00085 -0.00087
5*0.0 0.00413 -0.00010 0.0 -0.00089 6*0.0 -0.00116 -0.00050 0.0 -0.00104 -0.00090
5*0.0 0.00347 -0.00005 0.0 -0.00061 0.00010 5*0.0 -0.00054 -0.00050 0.0 -0.00119 -0.00091
5*0.0 0.00289 -0.00001 0.0 -0.00038 0.00017 5*0.0 -0.00003 -0.00050 0.0 -0.00130 -0.00091
5*0.0 0.00238 0.00002 0.0 -0.00018 0.00023 5*0.0 0.00040 -0.00049 0.0 -0.00137 -0.00089
5*0.0 0.00194 0.00005 0.0 -0.00002 0.00028 5*0.0 0.00074 -0.00048 0.0 -0.00141 -0.00087
5*0.0 0.00155 0.00007 0.0 0.00011 0.00031 5*0.0 0.00102 -0.00046 0.0 -0.00143 -0.00084
5*0.0 0.00121 0.00008 0.0 0.00022 0.00033 5*0.0 0.00123 -0.00044 0.0 -0.00143 -0.00081
5*0.0 0.00093 0.00009 0.0 0.00030 0.00035 5*0.0 0.00140 -0.00042 0.0 -0.00142 -0.00077
5*0.0 0.00068 0.00010 0.0 0.00037 0.00035 5*0.0 0.00151 -0.00040 0.0 -0.00139 -0.00073
5*0.0 0.00047 0.00011 0.0 0.00042 0.00035 5*0.0 0.00160 -0.00038 0.0 -0.00135 -0.00069
5*0.0 0.00029 0.00011 0.0 0.00045 0.00035 5*0.0 0.00165 -0.00035 0.0 -0.00130 -0.00065
5*0.0 0.00014 0.00011 0.0 0.00048 0.00034 5*0.0 0.00167 -0.00033 0.0 -0.00125 -0.00061
5*0.0 0.00001 0.00011 0.0 0.00049 0.00033 5*0.0 0.00167 -0.00031 0.0 -0.00119 -0.00057
5*0.0 -0.00009 0.00011 0.0 0.00050 0.00032 5*0.0 0.00165 -0.00029 0.0 -0.00113 -0.00053
5*0.0 -0.00017 0.00011 0.0 0.00050 0.00031 5*0.0 0.00162 -0.00026 0.0 -0.00107 -0.00049
5*0.0 -0.00024 0.00010 0.0 0.00049 0.00029 5*0.0 0.00158 -0.00024 0.0 -0.00101 -0.00046
5*0.0 -0.00029 0.00010 0.0 0.00048 0.00028 5*0.0 0.00152 -0.00023 0.0 -0.00094 -0.00042
5*0.0 -0.00034 0.00010 0.0 0.00047 0.00026 5*0.0 0.00146 -0.00021 0.0 -0.00088 -0.00039
5*0.0 -0.00037 0.00009 0.0 0.00045 0.00025 5*0.0 0.00140 -0.00019 0.0 -0.00082 -0.00036
5*0.0 -0.00039 0.00009 0.0 0.00043 0.00023 5*0.0 0.00133 -0.00017 0.0 -0.00077 -0.00033
5*0.0 -0.00040 0.00008 0.0 0.00042 0.00022 5*0.0 0.00126 -0.00016 0.0 -0.00071 -0.00030
5*0.0 -0.00041 0.00008 0.0 0.00040 0.00020 5*0.0 0.00119 -0.00014 0.0 -0.00066 -0.00027
5*0.0 -0.00041 0.00007 0.0 0.00037 0.00019 5*0.0 0.00112 -0.00013 0.0 -0.00061 -0.00025
5*0.0 -0.00041 0.00007 0.0 0.00035 0.00017 5*0.0 0.00105 -0.00012 0.0 -0.00056 -0.00023
5*0.0 -0.00040 0.00006 0.0 0.00033 0.00016 5*0.0 0.00098 -0.00011 0.0 -0.00051 -0.00021
5*0.0 -0.00039 0.00006 0.0 0.00031 0.00015 5*0.0 0.00091 -0.00010 0.0 -0.00047 -0.00019
5*0.0 -0.00038 0.00005 0.0 0.00029 0.00014 5*0.0 0.00085 -0.00009 0.0 -0.00043 -0.00017
5*0.0 -0.00036 0.00005 0.0 0.00027 0.00012 5*0.0 0.00078 -0.00008 0.0 -0.00039 -0.00015
5*0.0 -0.00035 0.00005 0.0 0.00025 0.00011 5*0.0 0.00073 -0.00007 0.0 -0.00036 -0.00014
5*0.0 -0.00033 0.00004 0.0 0.00023 0.00010 5*0.0 0.00067 -0.00006 0.0 -0.00033 -0.00012
5*0.0 -0.00032 0.00004 0.0 0.00022 0.00010 5*0.0 0.00062 -0.00006 0.0 -0.00030 -0.00011
5*0.0 -0.00030 0.00003 0.0 0.00020 0.00009 5*0.0 0.00057 -0.00005 0.0 -0.00027 -0.00010
5*0.0 -0.00028 0.00003 0.0 0.00019 0.00008 5*0.0 0.00052 -0.00005 0.0 -0.00025 -0.00009
5*0.0 -0.00027 0.00003 0.0 0.00017 0.00007 5*0.0 0.00047 -0.00004 0.0 -0.00022 -0.00008
5*0.0 -0.00025 0.00003 0.0 0.00016 0.00007 5*0.0 0.00043 -0.00004 0.0 -0.00020 -0.00007
5*0.0 -0.00023 0.00002 0.0 0.00014 0.00006 5*0.0 0.00039 -0.00003 0.0 -0.00018 -0.00006
5*0.0 -0.00022 0.00002 0.0 0.00013 0.00005 5*0.0 0.00036 -0.00003 0.0 -0.00016 -0.00006
5*0.0 -0.00020 0.00002 0.0 0.00012 0.00005 5*0.0 0.00033 -0.00003 0.0 -0.00015 -0.00005
5*0.0 -0.00019 0.00002 0.0 0.00011 0.00004 5*0.0 0.00030 -0.00002 0.0 -0.00013 -0.00005
5*0.0 -0.00017 0.00002 0.0 0.00010 0.00004 5*0.0 0.00027 -0.00002 0.0 -0.00012 -0.00004
5*0.0 -0.00016 0.00001 0.0 0.00009 0.00004 5*0.0 0.00024 -0.00002 0.0 -0.00011 -0.00004
5*0.0 -0.00015 0.00001 0.0 0.00008 0.00003 5*0.0 0.00022 -0.00002 0.0 -0.00010 -0.00003
5*0.0 -0.00014 0.00001 0.0 0.00008 0.00003 5*0.0 0.00020 -0.00001 0.0 -0.00009 -0.00003
5*0.0 -0.00013 0.00001 0.0 0.00007 0.00003 5*0.0 0.00018 -0.00001 0.0 -0.00008 -0.00002
5*0.0 -0.00012 0.00001 0.0 0.00006 0.00002 5*0.0 0.00016 -0.00001 0.0 -0.00007 -0.00002
5*0.0 -0.00011 0.00001 0.0 0.00006 0.00002 5*0.0 0.00014 -0.00001 0.0 -0.00006 -0.00002
5*0.0 -0.00010 0.00001 0.0 0.00005 0.00002 5*0.0 0.00013 -0.00001 0.0 -0.00005 -0.00002
5*0.0 -0.00009 0.00001 0.0 0.00005 0.00002 5*0.0 0.00011 -0.00001 0.0 -0.00005 -0.00002
5*0.0 -0.00008 0.00001 0.0 0.00004 0.00002 5*0.0 0.00010 -0.00001 0.0 -0.00004 -0.00001
5*0.0 -0.00007 0.00001 0.0 0.00004 0.00001 5*0.0 0.00009 -0.00001 0.0 -0.00004 -0.00001
5*0.0 -0.00007 0.00001 0.0 0.00003 0.00001 5*0.0 0.00008 2*0.0 -0.00003 -0.00001
5*0.0 -0.00006 2*0.0 0.00003 0.00001 5*0.0 0.00007 2*0.0 -0.00003 -0.00001
5*0.0 -0.00006 2*0.0 0.00003 0.00001 5*0.0 0.00006 2*0.0 -0.00003 -0.00001
5*0.0 -0.00005 2*0.0 0.00002 0.00001 5*0.0 0.00006 2*0.0 -0.00002 -0.00001
5*0.0 -0.00005 2*0.0 0.00002 0.00001 5*0.0 0.00005 2*0.0 -0.00002 -0.00001
5*0.0 -0.00004 2*0.0 0.00002 0.00001 5*0.0 0.00004 2*0.0 -0.00002 -0.00001
5*0.0 -0.00004 2*0.0 0.00002 0.00001 5*0.0 0.00004 2*0.0 -0.00002 0.0
5*0.0 -0.00003 2*0.0 0.00002 0.00001 5*0.0 0.00003 2*0.0 -0.00001 0.0
5*0.0 -0.00003 2*0.0 0.00001 6*0.0 0.00003 2*0.0 -0.00001 0.0
5*0.0 -0.00003 2*0.0 0.00001 6*0.0 0.00003 2*0.0 -0.00001 0.0
5*0.0 -0.00002 2*0.0 0.00001 6*0.0 0.00002 2*0.0 -0.00001 0.0
5*0.0 -0.00002 2*0.0 0.00001 6*0.0 0.00002 2*0.0 -0.00001 0.0
5*0.0 -0.00002 2*0.0 0.00001 6*0.0 0.00002 2*0.0 -0.00001 0.0
|