{ "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" [ [ 1.492003 2.387549 2.170669 ] [ 2.788135 3.420279 0.7006935 ] [ 2.516882 3.82705 3.771673 ] [ 3.610971 1.743132 2.445693 ] [ 4.42605 4.234183 2.406002 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.492003e-10 2.387549e-10 2.170669e-10 ] [ 2.788135e-10 3.420279e-10 7.006935e-11 ] [ 2.516882e-10 3.82705e-10 3.771673e-10 ] [ 3.610971e-10 1.743132e-10 2.445693e-10 ] [ 4.42605e-10 4.234183e-10 2.406002e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.754668 -0.4314451 1.3062188 ] [ 2.33086 0.312844 1.7733538 ] [ 1.0649345 -1.7670323 -2.3917964 ] [ -0.0890276 3.6753422 -0.0732219 ] [ -1.5520989 -1.7897088 -0.6145543 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.811288046865894e-09 -6.912512523787182e-10 2.092793223009431e-09 ] [ 3.734449398357888e-09 5.012313427575553e-10 2.841225998766839e-09 ] [ 1.706213158583337e-09 -2.831097839258452e-09 -3.832080273793605e-09 ] [ -1.426379393259341e-10 5.888547346279638e-09 -1.173144163105555e-10 ] [ -2.486736570749397e-09 -2.867429597400023e-09 -9.846245316721094e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -18.873507 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.023869166790515e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3214637 2.4200264 2.1886549 ] [ 2.9102018 3.3542907 0.7783407 ] [ 2.594294 3.6352763 3.7015966 ] [ 3.6194113 1.9899189 2.4783281 ] [ 4.3886701 4.2126807 2.3478102 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3214637e-10 2.4200264e-10 2.1886549e-10 ] [ 2.9102018e-10 3.3542907e-10 7.783407e-11 ] [ 2.594294e-10 3.6352763e-10 3.7015966e-10 ] [ 3.6194113e-10 1.9899189e-10 2.4783281e-10 ] [ 4.3886701e-10 4.2126807e-10 2.3478102e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.4e-06 -9.9e-05 6.6e-06 ] [ -2.34e-05 7.66e-05 0.0002026 ] [ -5.2e-06 1.28e-05 -0.0001922 ] [ -4.3e-05 6.65e-05 1.7e-06 ] [ 7.02e-05 -5.69e-05 -1.86e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.24304726912e-15 -1.586154854592e-13 1.057436569728e-14 ] [ -3.749093292672001e-14 1.2272672915328e-13 3.2460098337408e-13 ] [ -8.33131842816e-15 2.050786074624e-14 -3.079383465177601e-13 ] [ -6.889359469439999e-14 1.065447452832e-13 2.72370025536e-15 ] [ 1.1247279878016e-13 -9.116384972352e-14 -2.980048514688e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.467452 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.279247308174621e-18 } }