{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 3.044824 1.955008 1.363184 ] [ 4.804837 1.704442 0.3842414 ] [ 5.395877 3.200403 2.033527 ] [ 3.92549 3.943599 0.3069547 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.044824e-10 1.955008e-10 1.363184e-10 ] [ 4.804837e-10 1.704442e-10 3.842414e-11 ] [ 5.395877e-10 3.200403e-10 2.033527e-10 ] [ 3.92549e-10 3.943599e-10 3.069547e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.8880475 1.5826202 3.4958197 ] [ 5.1943325 -1.8328348 -3.9647741 ] [ -1.0717056 -0.0661354 0.6865319 ] [ -0.2345793 0.3163501 -0.2175775 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.229338805059888e-09 2.53563708404582e-09 5.60092059387207e-09 ] [ 8.322238092161615e-09 -2.936525066348644e-09 -6.352268369773361e-09 ] [ -1.717061656700437e-09 -1.059605916872563e-10 1.099945359613403e-09 ] [ -3.758374701836295e-10 5.068487342077421e-10 -3.48597583712112e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -10.836302 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.736166972032828e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.0641279 2.1022079 1.5921267 ] [ 4.9735088 1.7058305 0.1620516 ] [ 5.1995225 3.1068248 2.1201363 ] [ 3.9338688 3.8885889 0.2135924 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.0641279e-10 2.1022079e-10 1.5921267e-10 ] [ 4.9735088e-10 1.7058305e-10 1.620516e-11 ] [ 5.199522499999999e-10 3.1068248e-10 2.1201363e-10 ] [ 3.9338688e-10 3.8885889e-10 2.135924e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.73e-05 5.7e-06 -1.31e-05 ] [ 2.9e-06 -2.07e-05 1.5e-05 ] [ 1.12e-05 -1.54e-05 1.42e-05 ] [ -3.14e-05 3.04e-05 -1.61e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.771765553984e-14 9.13240673856e-15 -2.098851373248e-14 ] [ 4.646312200320001e-15 -3.316505605055999e-14 2.4032649312e-14 ] [ 1.794437815296e-14 -2.467351996032e-14 2.275090801536e-14 ] [ -5.030834589312e-14 4.870616927232e-14 -2.579504359488e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.299968 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.970672116618813e-18 } }