{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.3831539e-10 -1.242616e-11 2.3413242e-10 ] [ 1.8391e-11 2.5606637e-10 6.331539999999999e-12 ] [ 3.923152e-11 2.2402613e-10 2.4385704e-10 ] [ 2.1024278e-10 1.1145061e-10 2.135769e-11 ] [ 2.941805e-10 1.9572903e-10 2.4861113e-10 ] ] "source-value" [ [ 1.3831539 -0.1242616 2.3413242 ] [ 0.18391 2.5606637 0.0633154 ] [ 0.3923152 2.2402613 2.4385704 ] [ 2.1024278 1.1145061 0.2135769 ] [ 2.941805 1.9572903 2.4861113 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 5.46646641250752e-12 5.50059277453056e-12 5.875021450811519e-12 ] [ 1.22133923803584e-12 8.6421406925952e-13 -1.502344995557952e-11 ] [ 1.473730121110464e-11 -1.123958943023616e-11 -3.3853991997504e-12 ] [ -1.70006961233088e-11 1.172568981698688e-11 8.010242233351681e-12 ] [ -4.4244107383392e-12 -6.850747012878721e-12 4.523585471166721e-12 ] ] "source-value" [ [ 0.0034119 0.0034332 0.0036669 ] [ 0.0007623 0.0005394 -0.0093769 ] [ 0.0091983 -0.0070152 -0.002113 ] [ -0.010611 0.0073186 0.0049996 ] [ -0.0027615 -0.0042759 0.0028234 ] ] } "species" { "source-value" [ "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" -1.721399870336577e-18 "source-value" -10.744133 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -6.991322310023036e-09 -2.002935595841317e-08 2.101373359466802e-09 ] [ -4.699714685724975e-08 3.078383210291469e-08 -1.53329861528412e-08 ] [ -9.091385409449348e-09 6.10974112684703e-09 1.725864816143422e-09 ] [ 3.306565589148193e-08 -2.770923770387432e-08 -6.735477775024616e-09 ] [ 3.001419868524021e-08 1.084502043252577e-08 1.82412257522556e-08 ] ] "source-value" [ [ -4.3636402 -12.5013408 1.3115741 ] [ -29.3333121 19.2137569 -9.5700973 ] [ -5.6743965 3.8134005 1.0772001 ] [ 20.6379593 -17.294746 -4.2039546 ] [ 18.7333895 6.7689294 11.3852777 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -4.182095944032787e-20 "source-value" -0.2610259 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.422927e-10 2.017469e-11 2.232361e-10 ] [ 6.33062e-11 2.288682e-10 1.533226e-11 ] [ 4.085169000000001e-11 2.174523e-10 2.673779e-10 ] [ 1.949891e-10 1.221121e-10 2.190205e-11 ] [ 2.589215e-10 1.862387e-10 2.264415e-10 ] ] "source-value" [ [ 1.422927 0.2017469 2.232361 ] [ 0.633062 2.288682 0.1533226 ] [ 0.4085169 2.174523 2.673779 ] [ 1.949891 1.221121 0.2190205 ] [ 2.589215 1.862387 2.264415 ] ] } "instance-id" 1 }