{ "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" [ [ 2.875077 1.739271 0.5500127 ] [ 2.247142 4.095662 1.890424 ] [ 4.370849 2.938246 1.693427 ] [ 3.902852 1.049683 3.036341 ] [ 5.923496 0.662055 4.457524 ] [ 5.031061 2.817229 4.209838 ] [ 4.680107 5.055758 2.976326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.875077e-10 1.739271e-10 5.500127000000001e-11 ] [ 2.247142e-10 4.095662e-10 1.890424e-10 ] [ 4.370849e-10 2.938246e-10 1.693427e-10 ] [ 3.902852e-10 1.049683e-10 3.036341e-10 ] [ 5.923496e-10 6.62055e-11 4.457524e-10 ] [ 5.031061e-10 2.817229e-10 4.209838000000001e-10 ] [ 4.680106999999999e-10 5.055758e-10 2.976326e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.1934903 -4.7789396 -8.7409283 ] [ -6.3422556 4.8591436 0.6536584 ] [ 6.5905206 1.9058917 -10.3543849 ] [ -5.6688758 -10.4504911 2.1705862 ] [ 5.3245997 -4.6544743 2.4577072 ] [ 3.5891539 5.9513585 12.1061177 ] [ 1.7003477 7.1675112 1.7072437 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.320888739011578e-09 -7.656705299335305e-09 -1.400451096634909e-08 ] [ -1.016141364545788e-08 7.785206273029948e-09 1.047276206469535e-09 ] [ 1.055917802422079e-08 3.053575123516767e-09 -1.658955340954454e-08 ] [ -9.082540272978898e-09 -1.674353251629848e-08 3.477662463071113e-09 ] [ 8.530949154458694e-09 -7.457289905574446e-09 3.93768101661183e-09 ] [ 5.750458467033141e-09 9.535127450699359e-09 1.939613874759307e-08 ] [ 2.724257332171052e-09 1.148361887396215e-08 2.735305942148089e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -0.52953905 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.484150857106423e-20 } "relaxed-configuration-positions" { "source-value" [ [ 2.2659711 2.4854314 0.7613363 ] [ 2.2522563 4.4710245 2.1767954 ] [ 4.6558839 2.2172248 1.163654 ] [ 5.0108705 0.3636529 2.5660626 ] [ 5.2140308 1.1384812 4.7799123 ] [ 4.9893774 3.4820271 4.789002 ] [ 4.6421941 4.2000621 2.5771301 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2659711e-10 2.4854314e-10 7.613363e-11 ] [ 2.2522563e-10 4.4710245e-10 2.1767954e-10 ] [ 4.6558839e-10 2.2172248e-10 1.163654e-10 ] [ 5.010870500000001e-10 3.636529e-11 2.5660626e-10 ] [ 5.214030799999999e-10 1.1384812e-10 4.7799123e-10 ] [ 4.989377400000001e-10 3.4820271e-10 4.789002e-10 ] [ 4.6421941e-10 4.200062100000001e-10 2.577130100000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.7e-06 1.94e-05 8.2e-06 ] [ 2.14e-05 -7.1e-06 -8e-06 ] [ -1.69e-05 3.6e-06 4.5e-06 ] [ 6.9e-06 -9.1e-06 1.15e-05 ] [ 1.38e-05 -7e-07 -1.24e-05 ] [ -1.16e-05 -5e-06 2.6e-05 ] [ -2.13e-05 -1e-06 -2.97e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.233675998016e-14 3.108222644352e-14 1.313784829056e-14 ] [ 3.428657968511999e-14 -1.137545400768e-14 -1.28174129664e-14 ] [ -2.707678489152e-14 5.76783583488e-15 7.2097947936e-15 ] [ 1.105501868352e-14 -1.457980724928e-14 1.84250311392e-14 ] [ 2.211003736704e-14 -1.12152363456e-15 -1.986699009792e-14 ] [ -1.858524880128e-14 -8.010883104e-15 4.16565921408e-14 ] [ -3.412636202304e-14 -1.6021766208e-15 -4.758464563776e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.254682 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.604287147893859e-18 } }