{ "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" [ [ 1.558502 1.467528 2.474942 ] [ 1.379624 2.873279 4.407553 ] [ 1.24144 3.597751 1.918679 ] [ 3.591005 1.301821 3.64335 ] [ 3.465479 3.687448 2.931727 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.558502e-10 1.467528e-10 2.474942e-10 ] [ 1.379624e-10 2.873279e-10 4.407553e-10 ] [ 1.24144e-10 3.597751e-10 1.918679e-10 ] [ 3.591005e-10 1.301821e-10 3.64335e-10 ] [ 3.465479e-10 3.687448e-10 2.931727e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.9823875 -5.2218674 -0.9118247 ] [ -0.5818503 0.7365602 2.2417347 ] [ -1.1081412 3.6710265 -1.961217 ] [ 1.0625269 -0.3024628 0.3507683 ] [ 1.6098521 1.1167435 0.2805386 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.57395828506616e-09 -8.366353865197682e-09 -1.460904216607974e-09 ] [ -9.322269474654663e-10 1.180099532251772e-09 3.591654926376101e-09 ] [ -1.775437923185257e-09 5.881632832637251e-09 -3.142216025715514e-09 ] [ 1.702355758151099e-09 -4.845988268217062e-10 5.619927695777606e-10 ] [ 2.579267397565784e-09 1.789220327130365e-09 4.49472386151963e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -9.0920333 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.456704318879507e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.390752 1.1982267 2.3966006 ] [ 1.5049424 2.878222 4.4093002 ] [ 1.2492665 3.6784693 1.8810726 ] [ 3.5723148 1.36367 3.6814338 ] [ 3.5187743 3.809239 3.0078439 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.390752e-10 1.1982267e-10 2.3966006e-10 ] [ 1.5049424e-10 2.878222e-10 4.4093002e-10 ] [ 1.2492665e-10 3.678469300000001e-10 1.8810726e-10 ] [ 3.5723148e-10 1.36367e-10 3.6814338e-10 ] [ 3.5187743e-10 3.809239e-10 3.0078439e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.4e-06 1.29e-05 4.7e-06 ] [ -1.14e-05 1.11e-05 1.96e-05 ] [ 1.66e-05 -2.85e-05 -1.14e-05 ] [ 5.9e-06 2.42e-05 -3.48e-05 ] [ -2.8e-06 -1.98e-05 2.19e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.345828361472e-14 2.066807840832e-14 7.53023011776e-15 ] [ -1.826481347712e-14 1.778416049088e-14 3.140266176767999e-14 ] [ 2.659613190528e-14 -4.56620336928e-14 -1.826481347712e-14 ] [ 9.45284206272e-15 3.877267422336e-14 -5.575574640383999e-14 ] [ -4.48609453824e-15 -3.172309709184e-14 3.508766799552e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.43983 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.672645155112647e-18 } }