{ "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" [ [ 1.947833 2.66109 2.800328 ] [ 2.760428 0.8143556 5.686562 ] [ 2.02068 0.2574425 3.346376 ] [ 3.738236 1.129785 1.86566 ] [ 4.311233 0.7772723 4.159405 ] [ 3.473629 2.806736 4.589232 ] [ 4.175068 3.516721 2.41803 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.947833e-10 2.66109e-10 2.800328e-10 ] [ 2.760428e-10 8.143556e-11 5.686562e-10 ] [ 2.02068e-10 2.574425e-11 3.346376e-10 ] [ 3.738236e-10 1.129785e-10 1.86566e-10 ] [ 4.311233e-10 7.772723e-11 4.159405e-10 ] [ 3.473629e-10 2.806736e-10 4.589232e-10 ] [ 4.175068e-10 3.516721e-10 2.41803e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 10.7623798 -0.4751539 4.9876603 ] [ -2.1772068 -2.0715981 2.7565971 ] [ 5.7656659 6.4386973 -5.622631 ] [ -3.5624759 -3.0259134 12.2825946 ] [ -0.0602276 -0.1521747 -8.8900794 ] [ -2.5402241 4.3674538 -11.6463281 ] [ -8.1879112 -5.081311 6.1321866 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.724323329973018e-08 -7.612804698619412e-10 7.991112725152314e-09 ] [ -3.488269833606782e-09 -3.319066043513701e-09 4.41655542658508e-09 ] [ 9.23761510832379e-09 1.031593028246808e-08 -9.008447935585326e-09 ] [ -5.707715599143439e-09 -4.848047706045439e-09 1.967888591088433e-08 ] [ -9.649525264689408e-11 -2.438107466172538e-10 -1.424347737173569e-08 ] [ -4.069887664612721e-09 6.997432370784119e-09 -1.865947459998608e-08 ] [ -1.311847989782647e-08 -8.14115768721387e-09 9.824846004903041e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.490416 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.039879277446625e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3320819 2.2338498 3.6987194 ] [ 3.2985635 0.7592709 6.0380866 ] [ 1.6211996 0.660324 2.1787991 ] [ 3.7825276 0.1980034 2.1104747 ] [ 4.4603185 0.6032055 4.171822 ] [ 3.0725333 3.5585678 3.9528069 ] [ 4.8598826 3.950181 2.7148843 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3320819e-10 2.2338498e-10 3.6987194e-10 ] [ 3.2985635e-10 7.592709e-11 6.0380866e-10 ] [ 1.6211996e-10 6.60324e-11 2.1787991e-10 ] [ 3.7825276e-10 1.980034e-11 2.1104747e-10 ] [ 4.4603185e-10 6.032055e-11 4.171822e-10 ] [ 3.0725333e-10 3.5585678e-10 3.9528069e-10 ] [ 4.8598826e-10 3.950181e-10 2.7148843e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.2658202 -0.0720995 -0.1916374 ] [ 0.4390066 0.0212043 -0.1962637 ] [ 0.1343415 -0.0900598 -0.1365728 ] [ -0.2654025 -0.0625749 0.2549913 ] [ -0.1943604 -0.189499 0.1016739 ] [ 1.0987785 0.4624459 -0.701232 ] [ -0.9465436 -0.0694171 0.8690406 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.258909097763802e-10 -1.155161332713696e-10 -3.07036961950898e-10 ] [ 7.033661108968973e-10 3.397303372042944e-11 -3.144491116517049e-10 ] [ 2.152388105032032e-10 -1.442917060339238e-10 -2.188137471971942e-10 ] [ -4.25221680601872e-10 -1.002560418288979e-10 4.085410993673991e-10 ] [ -3.113996888893363e-10 -3.036108674649792e-10 1.628995455255571e-10 ] [ 1.760437224137693e-09 7.409200093648148e-10 -1.123497516156826e-09 ] [ -1.516530026487867e-09 -1.112184547037357e-10 1.392356531846004e-09 ] ] } "relaxed-potential-energy" { "source-value" -14.971115 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.398637044030819e-18 } }