{ "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" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.176849 1.681974 3.211274 ] [ 2.864727 5.809081 2.248654 ] [ 2.905691 3.612446 1.71083 ] [ 4.50356 2.090932 1.710731 ] [ 5.648677 2.904188 3.876429 ] [ 4.83518 4.522991 2.188517 ] [ 3.438619 4.083879 4.381538 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.176849e-10 1.681974e-10 3.211274e-10 ] [ 2.864727e-10 5.809081e-10 2.248654e-10 ] [ 2.905691e-10 3.612446e-10 1.71083e-10 ] [ 4.503560000000001e-10 2.090932e-10 1.710731e-10 ] [ 5.648677e-10 2.904188e-10 3.876429e-10 ] [ 4.835180000000001e-10 4.522991000000001e-10 2.188517e-10 ] [ 3.438619e-10 4.083879e-10 4.381538e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0 0.0 0.0 ] [ -1.2259604 3.44309 0.7046469 ] [ -5.268419 -2.969247 -1.8474719 ] [ 1.2722083 -1.9723557 -0.1278313 ] [ -0.1505894 0.9482163 -0.7838869 ] [ 5.3727606 0.5502965 2.0545432 ] [ 0.0 0.0 0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ -1.964205107089293e-09 5.51643834675906e-09 1.128968798400534e-09 ] [ -8.440937819921645e-09 -4.757258163974597e-09 -2.959976310151584e-09 ] [ 2.038302411840862e-09 -3.160062216476713e-09 -2.048083219538442e-10 ] [ -2.412708180080796e-10 1.519209999837934e-09 -1.255925274878695e-09 ] [ 8.608111493395819e-09 8.816721940719808e-10 3.291741108583588e-09 ] [ 0.0 0.0 0.0 ] ] } "unrelaxed-potential-energy" { "source-value" -7.9208259 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.269056217896202e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5827198 1.7329919 2.429831 ] [ 3.555219 4.258071 3.2560905 ] [ 2.6868701 2.54569 1.9822401 ] [ 3.9246182 1.6497846 0.2636406 ] [ 7.646989 4.2942293 3.6129789 ] [ 5.6520893 5.0830384 2.7969129 ] [ 2.3247975 5.1416858 4.986279 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.827198e-11 1.7329919e-10 2.429831e-10 ] [ 3.555219e-10 4.258071e-10 3.2560905e-10 ] [ 2.6868701e-10 2.54569e-10 1.9822401e-10 ] [ 3.9246182e-10 1.6497846e-10 2.636406e-11 ] [ 7.646989e-10 4.2942293e-10 3.6129789e-10 ] [ 5.6520893e-10 5.0830384e-10 2.7969129e-10 ] [ 2.3247975e-10 5.141685800000001e-10 4.986279e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.74e-05 1.58e-05 1.4e-06 ] [ -2.14e-05 -7e-07 1.1e-05 ] [ -3.67e-05 -1.38e-05 2.17e-05 ] [ 3.4e-06 -7.4e-06 -1.44e-05 ] [ 1.83e-05 -8.3e-06 8.3e-06 ] [ 2e-05 3.48e-05 -6.7e-06 ] [ -1e-06 -2.03e-05 -2.13e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.78778734316e-14 2.53143908172e-14 2.2430472876e-15 ] [ -3.42865799676e-14 -1.1215236438e-15 1.7623942974e-14 ] [ -5.879988246779999e-14 -2.21100375492e-14 3.476723295779999e-14 ] [ 5.4474005556e-15 -1.18561070916e-14 -2.30713435296e-14 ] [ 2.93198324022e-14 -1.32980660622e-14 1.32980660622e-14 ] [ 3.204353268e-14 5.575574686319999e-14 -1.07345834478e-14 ] [ -1.602176634e-15 -3.252418567019999e-14 -3.41263623042e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.820197 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.53467499786769e-18 } }