{ "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" [ [ 1.302275 0.3737398 2.647818 ] [ 0.2826825 1.480501 1.727575 ] [ 0.6414777 2.53008 2.452953 ] [ 2.763361 0.4669357 0.177905 ] [ 2.062003 2.101671 0.3497139 ] [ 2.601995 2.989286 1.853157 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.302275e-10 3.737398e-11 2.647818e-10 ] [ 2.826825e-11 1.480501e-10 1.727575e-10 ] [ 6.414777000000001e-11 2.53008e-10 2.452953e-10 ] [ 2.763361e-10 4.669357e-11 1.77905e-11 ] [ 2.062003e-10 2.101671e-10 3.497139e-11 ] [ 2.601995e-10 2.989286e-10 1.853157e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 32.5141457 -45.4376897 25.7442236 ] [ -120.3873892 -254.8721462 -229.5092988 ] [ 89.0835974 303.2790756 204.5235933 ] [ 30.4747103 -67.6940342 -4.4736938 ] [ -51.2470524 37.7201269 -43.0244295 ] [ 19.5619881 27.0046676 46.7396052 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.209340408582486e-08 -7.279920414050498e-08 4.124679317256761e-08 ] [ -1.928818604153904e-07 -4.083501939347596e-07 -3.677144327935615e-07 ] [ 1.427276570510397e-07 4.859066445041557e-07 3.276829195872675e-07 ] [ 4.882586836831296e-08 -1.084577989628756e-07 -7.167647614977913e-09 ] [ -8.210682924019252e-08 6.043430545278917e-08 -6.893273506815782e-08 ] [ 3.134175999018781e-08 4.326624708119525e-08 7.488510271686211e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 136.50945 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.187122493082665e-17 } "relaxed-configuration-positions" { "source-value" [ [ 1.2297081 -0.662232 2.1261619 ] [ 0.0264341 1.4443543 1.5252371 ] [ 0.7059851 3.1860534 3.1839604 ] [ 3.1402583 0.0066832 0.6381007 ] [ 1.9345419 2.1124968 0.0393903 ] [ 2.6168668 3.8548578 1.6962715 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2297081e-10 -6.62232e-11 2.1261619e-10 ] [ 2.64341e-12 1.4443543e-10 1.5252371e-10 ] [ 7.059851e-11 3.1860534e-10 3.1839604e-10 ] [ 3.1402583e-10 6.6832e-13 6.381007e-11 ] [ 1.9345419e-10 2.1124968e-10 3.93903e-12 ] [ 2.6168668e-10 3.8548578e-10 1.6962715e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9.4e-06 6.73e-05 -6.5e-05 ] [ -4e-06 3.19e-05 1.19e-05 ] [ 5.77e-05 -3.59e-05 -1.92e-05 ] [ 2.55e-05 -1.05e-05 2.42e-05 ] [ -2.56e-05 -0.0001064 1.54e-05 ] [ -4.43e-05 5.37e-05 3.26e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.506046023552e-14 1.0782648657984e-13 -1.04141480352e-13 ] [ -6.4087064832e-15 5.110943420352001e-14 1.906590178752e-14 ] [ 9.244559102016e-14 -5.751814068672e-14 -3.076179111936e-14 ] [ 4.08555038304e-14 -1.68228545184e-14 3.877267422336e-14 ] [ -4.101572149248001e-14 -1.7047159245312e-13 2.467351996032e-14 ] [ -7.097642430144e-14 8.603688453696e-14 5.223095783807999e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.296961 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.091713976668939e-18 } }