{ "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" [ [ 2.990348 2.100415 1.411886 ] [ 2.946969 3.752547 2.888488 ] [ 5.496135 2.06422 2.457996 ] [ 4.937229 4.674633 2.559339 ] [ 4.468449 3.37128 4.359326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.990348e-10 2.100415e-10 1.411886e-10 ] [ 2.946969e-10 3.752547e-10 2.888488e-10 ] [ 5.496135e-10 2.06422e-10 2.457996e-10 ] [ 4.937229e-10 4.674633e-10 2.559339e-10 ] [ 4.468449e-10 3.37128e-10 4.359326000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.8190162 -0.5880078 -0.0529073 ] [ -3.8634118 0.6338981 -0.8269434 ] [ -0.4061972 -0.0374271 -0.16836 ] [ 2.0763158 1.8282301 -1.8344081 ] [ 1.3742769 -1.8366933 2.8826188 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.312208607696457e-09 -9.420923500080422e-10 -8.476683912965184e-11 ] [ -6.189868062482846e-09 1.015616715789541e-09 -1.324909382204863e-09 ] [ -6.507996572744217e-10 -5.996482460434367e-11 -2.69742455877888e-10 ] [ 3.326624632157649e-09 2.929147523662846e-09 -2.939045770826148e-09 ] [ 2.201834319685499e-09 -2.942707064840001e-09 4.618464448038551e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.278457 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.486572688249811e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.1744581 1.9916364 1.5468512 ] [ 2.7430513 3.9316114 2.8705537 ] [ 5.4027194 2.2240587 2.3730699 ] [ 5.0661989 4.6908805 2.3957305 ] [ 4.4527023 3.124908 4.4908297 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.1744581e-10 1.9916364e-10 1.5468512e-10 ] [ 2.7430513e-10 3.9316114e-10 2.8705537e-10 ] [ 5.4027194e-10 2.2240587e-10 2.3730699e-10 ] [ 5.0661989e-10 4.6908805e-10 2.3957305e-10 ] [ 4.4527023e-10 3.124908e-10 4.4908297e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9e-07 -3.3e-06 -9e-07 ] [ -3.7e-06 1.1e-06 2.5e-06 ] [ 1.4e-06 4e-07 -7e-07 ] [ 4.5e-06 1.9e-06 -4e-07 ] [ -1.4e-06 -1e-07 -4e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.44195895872e-15 -5.28718284864e-15 -1.44195895872e-15 ] [ -5.928053496960001e-15 1.76239428288e-15 4.005441552e-15 ] [ 2.24304726912e-15 6.408706483200001e-16 -1.12152363456e-15 ] [ 7.2097947936e-15 3.04413557952e-15 -6.408706483200001e-16 ] [ -2.24304726912e-15 -1.6021766208e-16 -6.408706483200001e-16 ] ] } "relaxed-potential-energy" { "source-value" -10.393797 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.665269855474118e-18 } }