{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.8328 1.144076 3.909989 ] [ 1.831555 2.949109 3.983595 ] [ 4.980623 2.123246 2.998848 ] [ 3.28235 2.585733 1.880535 ] [ 4.448764 2.855471 5.04642 ] [ 4.331941 4.016039 3.033368 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8328e-10 1.144076e-10 3.909989e-10 ] [ 1.831555e-10 2.949109e-10 3.983595000000001e-10 ] [ 4.980622999999999e-10 2.123246e-10 2.998848e-10 ] [ 3.28235e-10 2.585733e-10 1.880535e-10 ] [ 4.448764e-10 2.855471e-10 5.04642e-10 ] [ 4.331941e-10 4.016039e-10 3.033368e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.0567931 -6.0194624 1.5807281 ] [ -5.6525599 2.0163809 1.3094549 ] [ 5.7563575 -3.7277915 -1.1924062 ] [ -2.6305261 -0.2406986 -6.1436104 ] [ 2.4904318 0.8362393 5.496048 ] [ 2.0930898 7.1353323 -1.0502144 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.295345818642757e-09 -9.644241927064658e-09 2.532605605661605e-09 ] [ -9.056399319451586e-09 3.230598336607663e-09 2.097978026772002e-09 ] [ 9.222701407466736e-09 -5.972580388516963e-09 -1.910445336136969e-09 ] [ -4.214567417824203e-09 -3.856416695792909e-10 -9.843148950183736e-09 ] [ 3.990111605656861e-09 1.339803055854158e-09 8.805639612394597e-09 ] [ 3.353499542794948e-09 1.143206259269909e-08 -1.6826289585075e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.6585601 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.547471918281171e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5479403 0.8267037 4.0516548 ] [ 1.6112533 3.0259928 4.1589292 ] [ 4.7176283 1.2946975 3.2160618 ] [ 4.1439924 2.9333694 1.4857261 ] [ 5.2637702 3.2595059 4.5760671 ] [ 3.4234484 4.3334046 3.364316 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5479403e-10 8.267037e-11 4.0516548e-10 ] [ 1.6112533e-10 3.0259928e-10 4.1589292e-10 ] [ 4.7176283e-10 1.2946975e-10 3.2160618e-10 ] [ 4.1439924e-10 2.9333694e-10 1.4857261e-10 ] [ 5.2637702e-10 3.2595059e-10 4.576067100000001e-10 ] [ 3.4234484e-10 4.3334046e-10 3.364316e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.2e-06 -1.59e-05 -2.29e-05 ] [ 3.46e-05 1.25e-05 3e-07 ] [ -1.88e-05 6.95e-05 6.7e-06 ] [ -1.25e-05 -4.2e-06 8.64e-05 ] [ -5.74e-05 2.8e-06 -5.69e-05 ] [ 5.19e-05 -6.47e-05 -1.35e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.52478856576e-15 -2.547460827072e-14 -3.668984461632e-14 ] [ 5.543531107968001e-14 2.002720776e-14 4.8065298624e-16 ] [ -3.012092047104e-14 1.113512751456e-13 1.073458335936e-14 ] [ -2.002720776e-14 -6.72914180736e-15 1.3842806003712e-13 ] [ -9.196493803392e-14 4.48609453824e-15 -9.116384972352e-14 ] [ 8.315296661952001e-14 -1.0366082736576e-13 -2.16293843808e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.186062 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.753510674001929e-18 } }