{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.7826629 0.079664 0.3147899 ] [ 0.4004832 1.295186 0.8087518 ] [ 0.7320587 0.6290848 2.788823 ] [ 1.344916 2.662801 0.2560168 ] [ 0.3963272 2.667865 2.000738 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.826629000000001e-11 7.9664e-12 3.147899e-11 ] [ 4.004832e-11 1.295186e-10 8.087518e-11 ] [ 7.320586999999999e-11 6.290848000000001e-11 2.788823e-10 ] [ 1.344916e-10 2.662801e-10 2.560168e-11 ] [ 3.963272e-11 2.667865e-10 2.000738e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 24.4277627 -96.695292 -45.423465 ] [ -44.8245106 33.4307389 2.972633 ] [ 2.7583106 -14.85518 32.4079217 ] [ 26.5347914 36.636527 -26.5866307 ] [ -8.8963541 41.4832061 36.629541 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.913759029639029e-08 -1.549229361838293e-07 -7.277641365872709e-08 ] [ -7.181678292212179e-08 5.356194828164911e-08 4.762683094818566e-09 ] [ 4.419300756224821e-09 -2.380062209377575e-08 5.1923214476457e-08 ] [ 4.25134224188849e-08 5.869818702670797e-08 -4.259647813338354e-08 ] [ -1.425353054937823e-08 6.646342296924794e-08 5.868699422083506e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 55.008734 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.813370755460607e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.519655 -0.4898684 0.8742619 ] [ 0.3773706 1.2322961 -0.7213653 ] [ 0.9545017 0.4921762 2.9667755 ] [ 0.7240681 3.2787112 0.3850324 ] [ 1.0808526 2.8212856 2.6644149 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.19655e-11 -4.898684e-11 8.742619000000001e-11 ] [ 3.773706e-11 1.2322961e-10 -7.213653e-11 ] [ 9.545017e-11 4.921762e-11 2.9667755e-10 ] [ 7.240681e-11 3.2787112e-10 3.850324e-11 ] [ 1.0808526e-10 2.8212856e-10 2.6644149e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.3e-06 2e-06 -1.01e-05 ] [ -1.31e-05 1e-05 -1.9e-05 ] [ 5.4e-06 2.05e-05 3.49e-05 ] [ 6.1e-06 -2.3e-06 -1.72e-05 ] [ -4.8e-06 -3.01e-05 1.13e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.009371271104e-14 3.2043532416e-15 -1.618198387008e-14 ] [ -2.098851373248e-14 1.6021766208e-14 -3.04413557952e-14 ] [ 8.65175375232e-15 3.28446207264e-14 5.591596406592e-14 ] [ 9.77327738688e-15 -3.68500622784e-15 -2.755743787776e-14 ] [ -7.69044777984e-15 -4.822551628608e-14 1.810459581504e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.83321 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.735671579021677e-18 } }