{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.1837152 1.359189 0.2246076 ] [ 1.439885 0.3143995 0.1278355 ] [ 1.736921 1.45075 1.267781 ] [ 2.492617 0.9019618 2.872525 ] [ 2.597932 2.758406 2.155931 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.837152e-11 1.359189e-10 2.246076e-11 ] [ 1.439885e-10 3.143995e-11 1.278355e-11 ] [ 1.736921e-10 1.45075e-10 1.267781e-10 ] [ 2.492617e-10 9.019618e-11 2.872525e-10 ] [ 2.597932e-10 2.758406e-10 2.155931e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -49.7164852 25.3060507 -10.7639472 ] [ 24.9092159 -65.0318406 -43.8614302 ] [ -5.4742674 20.6941393 19.880448 ] [ 9.3607875 -19.6438397 24.6177468 ] [ 20.9207492 38.6754904 10.1271825 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.965459025578922e-08 4.054476279631947e-08 -1.724574455136562e-08 ] [ 3.990896335743963e-08 -1.041924946169122e-07 -7.027375802129108e-08 ] [ -8.770743244287603e-09 3.315566617403848e-08 3.185198899663012e-08 ] [ 1.499763488477688e-08 -3.147290071008289e-08 3.944197837973401e-08 ] [ 3.35187352578603e-08 6.196496651685484e-08 1.62255350360749e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 57.701089 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.244733579050007e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.5546163 0.9548527 0.0254991 ] [ 1.3647246 -0.2217529 -0.4322822 ] [ 1.4976362 1.9420063 0.3281882 ] [ 2.7437084 1.2012993 3.5499231 ] [ 3.3996174 2.9083009 3.1773521 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.546163e-11 9.548527000000001e-11 2.54991e-12 ] [ 1.3647246e-10 -2.217529e-11 -4.322822e-11 ] [ 1.4976362e-10 1.9420063e-10 3.281882e-11 ] [ 2.7437084e-10 1.2012993e-10 3.5499231e-10 ] [ 3.3996174e-10 2.9083009e-10 3.1773521e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.7e-05 1.2e-06 1.2e-06 ] [ 1.62e-05 -2.91e-05 -1.06e-05 ] [ 2.08e-05 2.79e-05 9.4e-06 ] [ -3.41e-05 -8.87e-05 1.94e-05 ] [ 3.41e-05 8.87e-05 -1.94e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.92805349696e-14 1.92261194496e-15 1.92261194496e-15 ] [ 2.595526125696e-14 -4.662333966527999e-14 -1.698307218048e-14 ] [ 3.332527371264e-14 4.470072772032e-14 1.506046023552e-14 ] [ -5.463422276928e-14 -1.4211306626496e-13 3.108222644352e-14 ] [ 5.463422276928e-14 1.4211306626496e-13 -3.108222644352e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.166836 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.070865653390779e-18 } }