{ "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" [ [ 1.497272 0.041495 0.0459008 ] [ 0.5144624 2.623314 0.1336692 ] [ 0.1881884 1.665255 2.217108 ] [ 2.303156 0.3070008 2.474488 ] [ 2.009269 2.269424 0.9602388 ] [ 2.927445 2.103094 2.701001 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.497272e-10 4.1495e-12 4.59008e-12 ] [ 5.144624e-11 2.623314e-10 1.336692e-11 ] [ 1.881884e-11 1.665255e-10 2.217108e-10 ] [ 2.303156e-10 3.070008e-11 2.474488e-10 ] [ 2.009269e-10 2.269424e-10 9.602388e-11 ] [ 2.927445e-10 2.103094e-10 2.701001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.2654102 -2.6058799 -1.5182916 ] [ -10.0581574 2.8179771 -0.502183 ] [ -7.6999326 -1.4458173 4.649703 ] [ 1.6176465 -0.3465383 2.9775832 ] [ 16.3069676 4.0355369 -12.3106388 ] [ -0.4319343 -2.4552785 6.7038272 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.252340173618521e-10 -4.175079852392642e-09 -2.432571305077025e-09 ] [ -1.611494463460651e-08 4.514897027569784e-09 -8.045858619632066e-10 ] [ -1.233665199345576e-08 -2.31645467600818e-09 7.449645440263623e-09 ] [ 2.591755403018947e-09 -5.552155624717767e-10 4.770614189526851e-09 ] [ 2.612664224486308e-08 6.465642873555708e-09 -1.972381767247337e-08 ] [ -6.920350371816135e-10 -3.933789810252893e-09 1.074071520972313e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -6.9349166 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.111096124371783e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.112371 -0.1763689 0.0711913 ] [ 0.1945724 2.8726394 0.8244117 ] [ -0.2664739 1.5456367 2.2887466 ] [ 1.6604476 0.2546545 2.5413044 ] [ 2.388994 2.3515858 0.2273667 ] [ 3.3498817 2.1614353 2.5793852 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.112371e-10 -1.763689e-11 7.11913e-12 ] [ 1.945724e-11 2.8726394e-10 8.244117e-11 ] [ -2.664739e-11 1.5456367e-10 2.2887466e-10 ] [ 1.6604476e-10 2.546545e-11 2.5413044e-10 ] [ 2.388994e-10 2.3515858e-10 2.273667e-11 ] [ 3.3498817e-10 2.1614353e-10 2.5793852e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.7e-06 4.9e-06 1.14e-05 ] [ -1.29e-05 -3.82e-05 4.03e-05 ] [ 1.08e-05 3.18e-05 -4.35e-05 ] [ -4.7e-06 -2.9e-06 -6e-06 ] [ -7e-07 2.7e-06 -4.7e-06 ] [ 1.12e-05 1.7e-06 2.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.928053496960001e-15 7.850665441919999e-15 1.826481347712e-14 ] [ -2.066807840832e-14 -6.120314691456e-14 6.456771781824e-14 ] [ 1.730350750464e-14 5.094921654144e-14 -6.969468300480001e-14 ] [ -7.53023011776e-15 -4.646312200320001e-15 -9.6130597248e-15 ] [ -1.12152363456e-15 4.32587687616e-15 -7.53023011776e-15 ] [ 1.794437815296e-14 2.72370025536e-15 3.84522388992e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.314433 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.453642651340801e-18 } }