{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.9961381e-10 2.057517e-10 2.2741146e-10 ] [ 2.9858747e-10 1.759508e-10 4.697454600000001e-10 ] [ 1.7334913e-10 4.5563168e-10 2.0569554e-10 ] [ 1.2894718e-10 3.5882763e-10 4.2985706e-10 ] [ 4.4462902e-10 1.6305486e-10 2.6948433e-10 ] [ 3.7539189e-10 3.9401252e-10 3.4360355e-10 ] ] "source-value" [ [ 1.9961381 2.057517 2.2741146 ] [ 2.9858747 1.759508 4.6974546 ] [ 1.7334913 4.5563168 2.0569554 ] [ 1.2894718 3.5882763 4.2985706 ] [ 4.4462902 1.6305486 2.6948433 ] [ 3.7539189 3.9401252 3.4360355 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 5.30352505017216e-12 2.02563190167744e-12 7.44259105660224e-12 ] [ -8.034274882663682e-12 3.69013319302656e-12 -8.0381201065536e-13 ] [ 7.54577123098176e-12 -2.24432901041664e-12 9.081137086694401e-13 ] [ 9.671539171459201e-12 -8.51540852188992e-12 -8.486729560377601e-13 ] [ -6.73939573773312e-12 7.54160557176768e-12 -1.67219173912896e-12 ] [ -7.7473250498784e-12 -2.49763313416512e-12 -5.02586784178752e-12 ] ] "source-value" [ [ 0.0033102 0.0012643 0.0046453 ] [ -0.0050146 0.0023032 -0.0005017 ] [ 0.0047097 -0.0014008 0.0005668 ] [ 0.0060365 -0.0053149 -0.0005297 ] [ -0.0042064 0.0047071 -0.0010437 ] [ -0.0048355 -0.0015589 -0.0031369 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.169888179439323e-18 "source-value" -19.784886 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -9.099932060415343e-09 -1.180316146530904e-08 -1.081014873793873e-08 ] [ 5.913634868678772e-09 -6.870153697633485e-09 5.892509368845215e-09 ] [ -4.404723672675796e-09 5.229040980594803e-09 -6.849492508584634e-10 ] [ -4.961716369455364e-09 6.129311393834778e-09 1.954426846772212e-09 ] [ 7.350658162100737e-11 -2.248441317149247e-09 1.283978095420299e-09 ] [ 1.247923065224672e-08 9.563404105662193e-09 2.364183677759474e-09 ] ] "source-value" [ [ -5.6797309 -7.366954 -6.7471642 ] [ 3.6910006 -4.2880127 3.6778151 ] [ -2.7492123 3.2637107 -0.4275117 ] [ -3.0968598 3.8256153 1.2198573 ] [ 0.0458792 -1.4033667 0.8013961 ] [ 7.7889232 5.9690074 1.4756074 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.446358355334334e-18 "source-value" -15.268968 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.147227e-10 2.362862e-10 2.450911e-10 ] [ 2.622761e-10 1.752099e-10 4.557796e-10 ] [ 1.686581e-10 4.667086e-10 2.204349e-10 ] [ 1.229897e-10 3.438837e-10 4.460251000000001e-10 ] [ 4.850672999999999e-10 1.640741e-10 2.950795e-10 ] [ 3.668046e-10 3.670667e-10 2.833872e-10 ] ] "source-value" [ [ 2.147227 2.362862 2.450911 ] [ 2.622761 1.752099 4.557796 ] [ 1.686581 4.667086 2.204349 ] [ 1.229897 3.438837 4.460251 ] [ 4.850673 1.640741 2.950795 ] [ 3.668046 3.670667 2.833872 ] ] } "instance-id" 1 }