{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.971858 1.613185 3.540739 ] [ 1.980532 3.696797 1.101352 ] [ 1.421419 3.841396 3.166588 ] [ 2.933735 5.314328 3.389927 ] [ 3.610376 2.128489 1.767833 ] [ 4.452161 4.502678 1.60274 ] [ 4.038762 3.260824 3.402783 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.971858e-10 1.613185e-10 3.540739e-10 ] [ 1.980532e-10 3.696797e-10 1.101352e-10 ] [ 1.421419e-10 3.841396e-10 3.166588e-10 ] [ 2.933735e-10 5.314328e-10 3.389927e-10 ] [ 3.610376e-10 2.128489e-10 1.767833e-10 ] [ 4.452161e-10 4.502678000000001e-10 1.60274e-10 ] [ 4.038762e-10 3.260824e-10 3.402783e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.8526039 -13.9262719 9.5856045 ] [ -20.032443 0.954865 -30.8861905 ] [ -29.7870434 8.542748 8.311245 ] [ 0.4413003 20.3818608 14.1182638 ] [ 9.0710106 -25.323232 -16.3561364 ] [ 16.1372997 15.5986873 -13.0074018 ] [ 33.0224798 -6.2286572 28.2346153 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.41834350017829e-08 -2.231234725308399e-08 1.535783142613527e-08 ] [ -3.209551183210862e-08 1.529862379020192e-09 -4.948513232467507e-08 ] [ -4.772410453823495e-08 1.368699112298596e-08 1.331608242874089e-08 ] [ 7.070410234120262e-10 3.265534086215998e-08 2.261995218664697e-08 ] [ 1.453336111034898e-08 -4.057229027349443e-08 -2.620541934669588e-08 ] [ 2.585480430218285e-08 2.499185210722988e-08 -2.084015506131184e-08 ] [ 5.290784509640026e-08 -9.97940894481759e-09 4.523684053094198e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 13.604983 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.179758568898145e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2462896 1.9179636 3.124072 ] [ 3.3206528 3.1669784 0.2710507 ] [ 1.1867544 4.1019037 4.0368836 ] [ 3.3149379 4.9956765 3.5214968 ] [ 3.4032436 1.7562235 2.1675118 ] [ 3.261122 5.3509172 1.1838654 ] [ 4.6758427 3.0680341 3.6670818 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2462896e-10 1.9179636e-10 3.124072e-10 ] [ 3.3206528e-10 3.1669784e-10 2.710507e-11 ] [ 1.1867544e-10 4.101903700000001e-10 4.036883600000001e-10 ] [ 3.3149379e-10 4.9956765e-10 3.5214968e-10 ] [ 3.4032436e-10 1.7562235e-10 2.1675118e-10 ] [ 3.261122e-10 5.3509172e-10 1.1838654e-10 ] [ 4.675842699999999e-10 3.0680341e-10 3.6670818e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9.7e-06 -1.24e-05 -1.71e-05 ] [ -1.17e-05 -1.2e-05 -1.39e-05 ] [ 4e-06 1.33e-05 -6.4e-06 ] [ -6e-07 3.76e-05 2.58e-05 ] [ 4.7e-06 -2.79e-05 -1.2e-06 ] [ -1.34e-05 1.46e-05 -4.6e-06 ] [ 2.66e-05 -1.32e-05 1.73e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.554111322176e-14 -1.986699009792e-14 -2.739722021568e-14 ] [ -1.874546646336e-14 -1.92261194496e-14 -2.227025502912e-14 ] [ 6.4087064832e-15 2.130894905664e-14 -1.025393037312e-14 ] [ -9.6130597248e-16 6.024184094208e-14 4.133615681664e-14 ] [ 7.53023011776e-15 -4.470072772032e-14 -1.92261194496e-15 ] [ -2.146916671872e-14 2.339177866368e-14 -7.370012455680001e-15 ] [ 4.261789811328e-14 -2.114873139456e-14 2.771765553984e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.037353 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.889902527771674e-18 } }