{ "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" [ [ 0.7826629 0.079664 0.3147899 ] [ 0.4004832 1.295186 0.8087518 ] [ 0.7320587 0.6290848 2.788823 ] [ 1.344916 2.662801 0.2560168 ] [ 0.3963272 2.667865 2.000738 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.826629000000001e-11 7.9664e-12 3.147899e-11 ] [ 4.004832e-11 1.295186e-10 8.087518e-11 ] [ 7.320586999999999e-11 6.290848000000001e-11 2.788823e-10 ] [ 1.344916e-10 2.662801e-10 2.560168e-11 ] [ 3.963272e-11 2.667865e-10 2.000738e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 93.716869 -257.7505974 -103.2198741 ] [ -107.9839574 242.5827784 110.4915934 ] [ 3.4140401 -28.4162225 2.4318089 ] [ 70.2701225 6.8134806 -116.589743 ] [ -59.4170741 36.770561 106.8862148 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.50150977723439e-07 -4.129619845538211e-07 -1.653764704474418e-07 ] [ -1.730093733931314e-07 3.886604593632798e-07 1.770270491989086e-07 ] [ 5.469895275759023e-09 -4.552780771604506e-08 3.896187397933243e-09 ] [ 1.125851483378176e-07 1.09163994135323e-08 -1.86797361998665e-07 ] [ -9.519664778366656e-08 5.891293365327167e-08 1.71250595849265e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 127.88423 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.048931251630818e-17 } "relaxed-configuration-positions" { "source-value" [ [ 1.5066309 -0.664867 -0.1085698 ] [ -0.0291118 1.0687097 0.7040161 ] [ -0.1849148 0.9189623 3.2625015 ] [ 0.8334396 3.3694962 -0.0409182 ] [ 1.5304041 2.6422995 2.35209 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5066309e-10 -6.64867e-11 -1.085698e-11 ] [ -2.91118e-12 1.0687097e-10 7.040161000000001e-11 ] [ -1.849148e-11 9.189623000000001e-11 3.2625015e-10 ] [ 8.334395999999999e-11 3.3694962e-10 -4.09182e-12 ] [ 1.5304041e-10 2.6422995e-10 2.35209e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.3e-06 -6.2e-06 -0.0 ] [ 1.7e-06 -4.1e-06 -0.0 ] [ 7e-07 -2e-06 -4.6e-06 ] [ -4e-07 4.7e-06 1.3e-06 ] [ 1.3e-06 7.6e-06 3.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.2871828922e-15 -9.9334951308e-15 0.0 ] [ 2.7237002778e-15 -6.568924199399999e-15 0.0 ] [ 1.1215236438e-15 -3.204353268e-15 -7.370012516399999e-15 ] [ -6.408706536e-16 7.530230179799999e-15 2.0828296242e-15 ] [ 2.0828296242e-15 1.21765424184e-14 5.4474005556e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.168718 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.430296554733521e-18 } }