{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.1380952e-10 -1.670131e-11 1.2149311e-10 ] [ 5.708640000000001e-12 1.6198984e-10 1.332687e-11 ] [ 1.8191437e-10 3.0005328e-10 3.2110011e-10 ] [ 2.7409856e-10 -1.1011449e-10 -2.300776e-11 ] [ 2.2069578e-10 6.819821000000001e-11 3.130557e-10 ] [ 5.108837e-11 3.5836789e-10 1.3455885e-10 ] ] "source-value" [ [ 1.1380952 -0.1670131 1.2149311 ] [ 0.0570864 1.6198984 0.1332687 ] [ 1.8191437 3.0005328 3.2110011 ] [ 2.7409856 -1.1011449 -0.2300776 ] [ 2.2069578 0.6819821 3.130557 ] [ 0.5108837 3.5836789 1.3455885 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -5.892004522992e-12 -1.6374245064576e-12 -7.370012455680001e-15 ] [ 3.25466158749312e-12 2.86405092734208e-12 1.32291723579456e-12 ] [ 3.638222670512639e-12 -2.31418391108352e-12 2.0692111057632e-12 ] [ 3.82743972942912e-12 -2.03844931464384e-12 2.84770872580992e-12 ] [ 1.08755749019904e-12 1.41504239149056e-12 -5.26619433490752e-12 ] [ -5.915716736979839e-12 1.7111246310144e-12 -9.6643293766656e-13 ] ] "source-value" [ [ -0.0036775 -0.001022 -4.6e-06 ] [ 0.0020314 0.0017876 0.0008257 ] [ 0.0022708 -0.0014444 0.0012915 ] [ 0.0023889 -0.0012723 0.0017774 ] [ 0.0006788 0.0008832 -0.0032869 ] [ -0.0036923 0.001068 -0.0006032 ] ] } "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" -2.224079740976997e-18 "source-value" -13.881614 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -6.393938980959594e-08 -8.585313090032044e-08 1.207467753070616e-08 ] [ -7.824399150115646e-08 -1.672992202590478e-08 -8.129515358646464e-08 ] [ -4.041591415029812e-08 3.859250930213338e-08 1.006029995848387e-07 ] [ 2.167864121817689e-08 -2.350045734800444e-08 -4.206974270230544e-08 ] [ 1.041002424086102e-07 -1.130634091478855e-08 6.079463865981333e-08 ] [ 5.682041183426339e-08 9.879734188688484e-08 -5.010741948658807e-08 ] ] "source-value" [ [ -39.9078285 -53.58531 7.536421 ] [ -48.8360587 -10.4419961 -50.7404443 ] [ -25.2256297 24.0875499 62.791454 ] [ 13.5307437 -14.6678319 -26.2578683 ] [ 64.9742613 -7.056863 37.9450292 ] [ 35.4645119 61.6644511 -31.2745916 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 1.076916954607321e-17 "source-value" 67.21587 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.248369e-10 1.750326e-11 1.959235e-10 ] [ 2.041437e-11 1.690187e-10 8.451771e-11 ] [ 5.672117e-11 2.337944e-10 2.235934e-10 ] [ 2.305261e-10 1.883321e-12 1.900716e-11 ] [ 2.629759e-10 4.646214e-11 2.471997e-10 ] [ 1.518408e-10 2.931316e-10 1.102854e-10 ] ] "source-value" [ [ 1.248369 0.1750326 1.959235 ] [ 0.2041437 1.690187 0.8451771 ] [ 0.5672117 2.337944 2.235934 ] [ 2.305261 0.01883321 0.1900716 ] [ 2.629759 0.4646214 2.471997 ] [ 1.518408 2.931316 1.102854 ] ] } "instance-id" 1 }