{ "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" [ [ 1.888839 2.682802 2.483288 ] [ 4.584027 1.697115 1.780244 ] [ 5.622084 2.160801 4.094107 ] [ 3.250182 0.9950144 3.979579 ] [ 5.691266 3.575432 2.207922 ] [ 3.710937 3.502612 1.042458 ] [ 3.524601 3.924526 3.14177 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.888839e-10 2.682802e-10 2.483288e-10 ] [ 4.584027e-10 1.697115e-10 1.780244e-10 ] [ 5.622084000000001e-10 2.160801e-10 4.094107000000001e-10 ] [ 3.250182e-10 9.950144e-11 3.979579e-10 ] [ 5.691266e-10 3.575432e-10 2.207922e-10 ] [ 3.710937e-10 3.502612e-10 1.042458e-10 ] [ 3.524601e-10 3.924526e-10 3.14177e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.4976017 -3.02897 0.2203926 ] [ 4.5750191 -15.9274349 -2.538305 ] [ 0.2422736 -1.7060249 2.0785947 ] [ 0.0676058 0.6001981 -0.8969238 ] [ 7.458378 5.2754784 0.6228666 ] [ -4.4977662 4.1782254 -11.2254247 ] [ -1.3479086 10.6085278 11.7387997 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.041030562077868e-08 -4.85294495908698e-09 3.531078740265083e-10 ] [ 7.329988702123708e-09 -2.551856403633613e-08 -4.066812960965369e-09 ] [ 3.881651009550624e-10 -2.733353231802187e-09 3.33027585989624e-09 ] [ 1.083164330828772e-10 9.616233715911952e-10 -1.437030354838489e-09 ] [ 1.194963895913965e-08 8.452248225651704e-09 9.979423126190243e-10 ] [ -7.20621591083497e-09 6.694255107465302e-09 -1.798511316106646e-08 ] [ -2.159587663687652e-09 1.699673536229942e-08 1.880763059054621e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -10.455605 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.675172602533357e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9730738 2.7787374 2.914701 ] [ 4.9309974 1.2837916 1.6433772 ] [ 5.6479895 1.7056982 4.1195463 ] [ 3.3118771 0.9245344 3.5929694 ] [ 5.5490132 3.7038886 2.5804487 ] [ 3.5079073 3.2547662 0.9224177 ] [ 3.3510777 4.8868862 2.9559076 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9730738e-10 2.7787374e-10 2.914701e-10 ] [ 4.9309974e-10 1.2837916e-10 1.6433772e-10 ] [ 5.6479895e-10 1.7056982e-10 4.1195463e-10 ] [ 3.3118771e-10 9.245344e-11 3.5929694e-10 ] [ 5.5490132e-10 3.7038886e-10 2.5804487e-10 ] [ 3.5079073e-10 3.2547662e-10 9.224177000000001e-11 ] [ 3.3510777e-10 4.8868862e-10 2.9559076e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.1e-06 -2e-05 2.27e-05 ] [ 3.5e-06 1.23e-05 1.94e-05 ] [ -2.06e-05 8.5e-06 -2.65e-05 ] [ 6e-07 -2.51e-05 -1e-06 ] [ 3e-06 -1.06e-05 1.56e-05 ] [ -2e-07 6.3e-06 -1.08e-05 ] [ 1.27e-05 2.86e-05 -1.93e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.7623942974e-15 -3.204353268e-14 3.636940959179999e-14 ] [ 5.607618218999999e-15 1.97067725982e-14 3.10822266996e-14 ] [ -3.300483866039999e-14 1.3618501389e-14 -4.2457680801e-14 ] [ 9.613059803999998e-16 -4.02146335134e-14 -1.602176634e-15 ] [ 4.806529901999999e-15 -1.69830723204e-14 2.49939554904e-14 ] [ -3.204353268e-16 1.00937127942e-14 -1.73035076472e-14 ] [ 2.03476432518e-14 4.58222517324e-14 -3.09220090362e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.993828 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.722711414381495e-18 } }