{ "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" [ [ 2.384535 1.809355 2.901981 ] [ 1.948299 3.967012 2.633856 ] [ 1.645033 3.274995 4.707865 ] [ 4.440095 1.758867 2.666287 ] [ 3.649735 2.240012 5.07701 ] [ 4.164388 4.024114 1.736165 ] [ 3.303688 4.596831 4.046686 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.384535e-10 1.809355e-10 2.901981e-10 ] [ 1.948299e-10 3.967012e-10 2.633856000000001e-10 ] [ 1.645033e-10 3.274995e-10 4.707865e-10 ] [ 4.440095e-10 1.758867e-10 2.666287e-10 ] [ 3.649735e-10 2.240012e-10 5.07701e-10 ] [ 4.164388e-10 4.024114e-10 1.736165e-10 ] [ 3.303688e-10 4.596831e-10 4.046686e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.7978942 -6.578597 -2.3959775 ] [ -3.9728007 2.5212478 -4.2850703 ] [ -1.8733612 -0.2212823 2.2444956 ] [ 3.4316474 -1.4920311 -0.7840849 ] [ 2.5922433 -1.4842867 2.8034516 ] [ 1.7008737 0.8628654 -0.5764006 ] [ 2.9192917 6.3920838 2.9935861 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.687073916311919e-09 -1.054007431106502e-08 -3.838779134462832e-09 ] [ -6.365128400637874e-09 4.039484280403434e-09 -6.865439453144443e-09 ] [ -3.001455516953833e-09 -3.545333276568518e-10 3.596078375808469e-09 ] [ 5.498105235109106e-09 -2.390497345926507e-09 -1.256242495502306e-09 ] [ 4.15323161068544e-09 -2.378089449304383e-09 4.491624611064353e-09 ] [ 2.725100077073593e-09 1.38246277077724e-09 -9.234955655350927e-10 ] [ 4.677220911035487e-09 1.024124722255442e-08 4.796253661771851e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.010363 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.244707604752135e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5779309 1.3883612 1.8182615 ] [ 1.5769322 3.4426591 2.4299246 ] [ 1.4759485 3.2682754 4.7862679 ] [ 4.1081466 0.9668958 3.6317958 ] [ 3.7859406 2.8342176 5.0479764 ] [ 3.2403411 5.0961199 2.1210352 ] [ 4.7705332 4.6746569 3.9345886 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5779309e-10 1.3883612e-10 1.8182615e-10 ] [ 1.5769322e-10 3.4426591e-10 2.4299246e-10 ] [ 1.4759485e-10 3.2682754e-10 4.786267900000001e-10 ] [ 4.108146600000001e-10 9.668958e-11 3.6317958e-10 ] [ 3.7859406e-10 2.8342176e-10 5.0479764e-10 ] [ 3.2403411e-10 5.0961199e-10 2.1210352e-10 ] [ 4.7705332e-10 4.6746569e-10 3.9345886e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.3e-06 -5.3e-06 -2.07e-05 ] [ 1.74e-05 -5.4e-06 2e-06 ] [ 5.5e-06 -2.3e-06 3.7e-06 ] [ -2.52e-05 1.22e-05 6.9e-06 ] [ 1.88e-05 -3e-07 2.5e-05 ] [ -1.34e-05 1.67e-05 -1.34e-05 ] [ -9.4e-06 -1.55e-05 -3.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.009371271104e-14 -8.491536090240001e-15 -3.316505605055999e-14 ] [ 2.787787320192e-14 -8.65175375232e-15 3.2043532416e-15 ] [ 8.8119714144e-15 -3.68500622784e-15 5.928053496960001e-15 ] [ -4.037485084416e-14 1.954655477376e-14 1.105501868352e-14 ] [ 3.012092047104e-14 -4.8065298624e-16 4.005441552e-14 ] [ -2.146916671872e-14 2.675634956736e-14 -2.146916671872e-14 ] [ -1.506046023552e-14 -2.48337376224e-14 -5.76783583488e-15 ] ] } "relaxed-potential-energy" { "source-value" -21.442861 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.435525057726411e-18 } }