{ "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" [ [ 2.327038 2.33879 1.333944 ] [ 3.095823 1.457233 3.921802 ] [ 1.16952 4.791902 2.053879 ] [ 1.997895 3.950607 4.032131 ] [ 4.742513 1.791132 2.167365 ] [ 3.563011 4.139404 2.001972 ] [ 4.473125 3.165685 4.251983 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.327038e-10 2.33879e-10 1.333944e-10 ] [ 3.095823e-10 1.457233e-10 3.921802e-10 ] [ 1.16952e-10 4.791902e-10 2.053879e-10 ] [ 1.997895e-10 3.950607e-10 4.032131e-10 ] [ 4.742513e-10 1.791132e-10 2.167365e-10 ] [ 3.563011e-10 4.139404e-10 2.001972e-10 ] [ 4.473124999999999e-10 3.165685e-10 4.251983e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.7739821 -5.450613 -1.9482792 ] [ -8.2904042 -8.0885049 0.4074207 ] [ -1.431732 0.0247673 -2.7071257 ] [ 1.3204636 -1.5016104 5.4085382 ] [ 0.462082 0.201441 -2.312289 ] [ 6.0481364 6.7105285 -0.6197496 ] [ 4.6654363 8.1039913 1.7714846 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.444409267137688e-09 -8.73284471762855e-09 -3.121487385030927e-09 ] [ -1.328269178622213e-08 -1.295921344800624e-08 6.527599203699706e-10 ] [ -2.293887537651226e-09 3.968158902033984e-11 -4.337293506106836e-09 ] [ 2.115615908537403e-09 -2.405845076430137e-09 8.665433456743714e-09 ] [ 7.403369772925055e-10 3.227440606705728e-10 -3.704695376333011e-09 ] [ 9.690182739489476e-09 1.075145187591209e-08 -9.929483198701518e-10 ] [ 7.474852965691655e-09 1.29840253960266e-08 2.83823121022724e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.896239 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.546858248444917e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0005802 1.9624365 1.4721365 ] [ 2.755842 1.4303538 3.8321982 ] [ 1.6800973 4.3518366 2.0007946 ] [ 1.8982487 3.7504608 4.3845286 ] [ 4.488824 2.081695 1.938879 ] [ 4.1357676 4.5914317 1.9399861 ] [ 4.4095652 3.4665386 4.194553 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0005802e-10 1.9624365e-10 1.4721365e-10 ] [ 2.755842e-10 1.4303538e-10 3.8321982e-10 ] [ 1.6800973e-10 4.351836600000001e-10 2.0007946e-10 ] [ 1.8982487e-10 3.7504608e-10 4.3845286e-10 ] [ 4.488824e-10 2.081695e-10 1.938879e-10 ] [ 4.1357676e-10 4.5914317e-10 1.9399861e-10 ] [ 4.409565200000001e-10 3.4665386e-10 4.194553e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.7e-06 -9e-06 -3.8e-06 ] [ -3e-06 1.2e-05 1.65e-05 ] [ -2.23e-05 1.44e-05 8e-06 ] [ -1.89e-05 -6.1e-06 -7.2e-06 ] [ 9.3e-06 2e-07 -1.18e-05 ] [ 1.49e-05 5e-07 -6.9e-06 ] [ 1.53e-05 -1.21e-05 5.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.53023011776e-15 -1.44195895872e-14 -6.08827115904e-15 ] [ -4.8065298624e-15 1.92261194496e-14 2.64359142432e-14 ] [ -3.572853864384e-14 2.307134333952e-14 1.28174129664e-14 ] [ -3.028113813312e-14 -9.77327738688e-15 -1.153567166976e-14 ] [ 1.490024257344e-14 3.2043532416e-16 -1.890568412544e-14 ] [ 2.387243164992e-14 8.010883104e-16 -1.105501868352e-14 ] [ 2.451330229824e-14 -1.938633711168e-14 8.33131842816e-15 ] ] } "relaxed-potential-energy" { "source-value" -21.881227 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.505759033381772e-18 } }