{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.061869 2.942366 1.677644 ] [ 1.882152 2.580028 5.41738 ] [ 1.143094 3.952812 3.395101 ] [ 3.99886 1.876175 2.533949 ] [ 4.004626 1.895608 4.810911 ] [ 3.218518 3.766044 3.544324 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.061869e-10 2.942366e-10 1.677644e-10 ] [ 1.882152e-10 2.580028e-10 5.41738e-10 ] [ 1.143094e-10 3.952812e-10 3.395101e-10 ] [ 3.99886e-10 1.876175e-10 2.533949e-10 ] [ 4.004626e-10 1.895608e-10 4.810911e-10 ] [ 3.218518e-10 3.766044e-10 3.544324e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.4079549 -2.6700273 -8.7500923 ] [ -2.7462376 -0.6806497 2.9012627 ] [ -7.0706188 2.2501211 2.0313883 ] [ 3.7512304 -5.3118622 -4.2768071 ] [ 3.0211884 -4.0446818 4.6036672 ] [ 6.4523924 10.4570999 3.4905811 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.460145710505806e-09 -4.277855352202108e-09 -1.401919342840332e-08 ] [ -4.399957714132238e-09 -1.09052104527911e-09 4.648335307035752e-09 ] [ -1.132838022928112e-08 3.605091450090377e-09 3.254642868840982e-09 ] [ 6.010133695630473e-09 -8.510541499867835e-09 -6.852200403745301e-09 ] [ 4.840477461391845e-09 -6.48029467192506e-09 7.375888018552204e-09 ] [ 1.033787233667918e-08 1.675412111918373e-08 5.592527477502017e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.936706 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.23290647081276e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1460683 3.0085894 1.5422359 ] [ 1.916011 2.8948862 5.5110334 ] [ 0.803655 3.713136 3.4773076 ] [ 4.0881064 1.7559022 2.3801578 ] [ 3.94626 1.6858867 4.8333078 ] [ 3.4090183 3.9546324 3.6352664 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1460683e-10 3.0085894e-10 1.5422359e-10 ] [ 1.916011e-10 2.8948862e-10 5.5110334e-10 ] [ 8.03655e-11 3.713136e-10 3.4773076e-10 ] [ 4.0881064e-10 1.7559022e-10 2.3801578e-10 ] [ 3.94626e-10 1.6858867e-10 4.8333078e-10 ] [ 3.4090183e-10 3.9546324e-10 3.6352664e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.1e-06 6.2e-06 -5.8e-06 ] [ 1.1e-06 1.22e-05 2.08e-05 ] [ 3.51e-05 -3.94e-05 9.6e-06 ] [ 4.2e-06 -3.6e-06 -1.59e-05 ] [ -3.93e-05 -9.3e-06 2.8e-06 ] [ -2.2e-06 3.39e-05 -1.15e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.7623942974e-15 9.9334951308e-15 -9.2926244772e-15 ] [ 1.7623942974e-15 1.95465549348e-14 3.332527398719999e-14 ] [ 5.62363998534e-14 -6.31257593796e-14 1.53808956864e-14 ] [ 6.729141862799999e-15 -5.767835882399999e-15 -2.54746084806e-14 ] [ -6.29655417162e-14 -1.49002426962e-14 4.486094575199999e-15 ] [ -3.5247885948e-15 5.431378789259999e-14 -1.8425031291e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.996905 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.043639730931777e-18 } }