{ "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" [ [ 0.7446066 0.1944515 0.1494579 ] [ 0.9752316 0.2958523 2.14555 ] [ 1.483774 1.800686 1.444998 ] [ 2.76885 0.9073334 0.4143235 ] [ 2.782831 0.444621 2.68949 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.446066e-11 1.944515e-11 1.494579e-11 ] [ 9.752316e-11 2.958523e-11 2.14555e-10 ] [ 1.483774e-10 1.800686e-10 1.444998e-10 ] [ 2.76885e-10 9.073334e-11 4.143235000000001e-11 ] [ 2.782831e-10 4.44621e-11 2.68949e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.5724201 -6.7801717 -15.4908831 ] [ -24.444561 -27.4407939 19.3562157 ] [ -5.0101607 42.2464925 -0.688755 ] [ 20.2919773 -6.1288077 -14.1451054 ] [ 18.7351646 -1.8967192 10.9685278 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.5336707688696e-08 -1.086303258274979e-08 -2.481913073836583e-08 ] [ -3.916450413991947e-08 -4.396499844277125e-08 3.10120762617019e-08 ] [ -8.027162339990963e-09 6.768634259430255e-08 -1.103507158459104e-09 ] [ 3.25113316198643e-08 -9.81943241031902e-09 -2.266295717063183e-08 ] [ 3.001704270895978e-08 -3.038879158462479e-09 1.757351880575486e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 12.744115 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.041832310578659e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.6856177 0.1919671 -0.0283862 ] [ 0.5372656 -0.0693942 2.4934896 ] [ 1.3837901 2.2278148 1.5025349 ] [ 3.1484854 0.7769433 0.1771524 ] [ 3.0001343 0.5156131 2.6990286 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.856177000000001e-11 1.919671e-11 -2.83862e-12 ] [ 5.372656e-11 -6.93942e-12 2.4934896e-10 ] [ 1.3837901e-10 2.2278148e-10 1.5025349e-10 ] [ 3.1484854e-10 7.769433e-11 1.771524e-11 ] [ 3.0001343e-10 5.156131000000001e-11 2.6990286e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.1e-06 2.37e-05 2.41e-05 ] [ 6.2e-06 -2.1e-06 1.94e-05 ] [ 1.84e-05 -4.61e-05 -3.74e-05 ] [ 7.4e-06 3.06e-05 -1.14e-05 ] [ -3.31e-05 -6e-06 5.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.76239428288e-15 3.797158591296e-14 3.861245656128e-14 ] [ 9.93349504896e-15 -3.36457090368e-15 3.108222644352e-14 ] [ 2.948004982272e-14 -7.386034221888001e-14 -5.992140561792e-14 ] [ 1.185610699392e-14 4.902660459647999e-14 -1.826481347712e-14 ] [ -5.303204614848e-14 -9.6130597248e-15 8.491536090240001e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.338031 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.656335157330565e-18 } }