{ "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" [ [ 0.8495841 0.5267621 0.8966685 ] [ 0.1884113 0.623136 2.979456 ] [ 1.483282 2.75051 2.967402 ] [ 1.97645 1.30316 2.052926 ] [ 2.403862 2.938822 1.215589 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.495841e-11 5.267621e-11 8.966685e-11 ] [ 1.884113e-11 6.23136e-11 2.979456e-10 ] [ 1.483282e-10 2.75051e-10 2.967402e-10 ] [ 1.97645e-10 1.30316e-10 2.052926e-10 ] [ 2.403862e-10 2.938822e-10 1.215589e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -13.9468955 -14.5533611 -18.1779713 ] [ -8.1164938 -1.9494624 8.5375913 ] [ -12.0983697 19.4250971 22.8872761 ] [ 21.8630615 -23.1559664 2.3987006 ] [ 12.2986974 20.2336929 -15.6455967 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.234539008693974e-08 -2.331705510058453e-08 -2.91243208703826e-08 ] [ -1.300405671636587e-08 -3.123383106141561e-09 1.367872929150168e-08 ] [ -1.938372524283359e-08 3.112243668680116e-08 3.666945898332665e-08 ] [ 3.502848628300499e-08 -3.709994830376909e-08 3.84314205328178e-09 ] [ 1.970468560291655e-08 3.24179499839117e-08 -2.50670094577275e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 8.3021689 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.330154102310148e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.8137512 -0.151115 1.3762945 ] [ -0.2940074 1.1450512 2.9542585 ] [ 0.9120947 3.1092966 3.2444373 ] [ 2.7044854 1.0120562 0.6912375 ] [ 2.7652655 3.0271011 1.8458136 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.137512000000001e-11 -1.51115e-11 1.3762945e-10 ] [ -2.940074e-11 1.1450512e-10 2.9542585e-10 ] [ 9.120947e-11 3.1092966e-10 3.2444373e-10 ] [ 2.7044854e-10 1.0120562e-10 6.912375e-11 ] [ 2.7652655e-10 3.0271011e-10 1.8458136e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4e-07 3e-07 -0.0 ] [ 1e-07 -0.0 2e-07 ] [ -2e-07 -1e-07 2e-07 ] [ 7e-07 -3e-07 -2e-07 ] [ -2e-07 1e-07 -2e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.408706536e-16 4.806529901999999e-16 0.0 ] [ 1.602176634e-16 0.0 3.204353268e-16 ] [ -3.204353268e-16 -1.602176634e-16 3.204353268e-16 ] [ 1.1215236438e-15 -4.806529901999999e-16 -3.204353268e-16 ] [ -3.204353268e-16 1.602176634e-16 -3.204353268e-16 ] ] } "relaxed-potential-energy" { "source-value" -12.435516 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.992389316693314e-18 } }