{ "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" [ [ 2.147227 2.362862 2.450911 ] [ 2.622761 1.752099 4.557796 ] [ 1.686581 4.667086 2.204349 ] [ 1.229897 3.438837 4.460251 ] [ 4.850673 1.640741 2.950795 ] [ 3.668046 3.670667 2.833872 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.147227e-10 2.362862e-10 2.450911e-10 ] [ 2.622761e-10 1.752099e-10 4.557796e-10 ] [ 1.686581e-10 4.667086e-10 2.204349e-10 ] [ 1.229897e-10 3.438837e-10 4.460251000000001e-10 ] [ 4.850672999999999e-10 1.640741e-10 2.950795e-10 ] [ 3.668046e-10 3.670667e-10 2.833872e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.6389776 -137.5271878 -56.1152832 ] [ 33.1612446 -41.265677 -3.2948105 ] [ -27.1039304 52.6899465 30.8806789 ] [ -45.5956547 76.2290704 18.3786794 ] [ 2.4424698 -28.0139847 18.3048674 ] [ 47.7348484 77.8878325 -8.154132 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.70455213203694e-08 -2.203428468328899e-07 -8.990659555333273e-08 ] [ 5.313017125247868e-08 -6.611490347559121e-08 -5.278868396557857e-09 ] [ -4.342528397644227e-08 8.441860112901007e-08 4.947630217563682e-08 ] [ -7.305229257227227e-08 1.22132435426421e-07 2.944589069845714e-08 ] [ 3.913268042810653e-09 -4.48833517115735e-08 2.932763083674833e-08 ] [ 7.647965873401227e-08 1.247900653044058e-07 -1.306435976095169e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 47.643701 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.633362449948243e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9758303 1.7523346 1.8833081 ] [ 2.3682681 1.2566013 4.7582011 ] [ 1.6340161 4.4541657 2.2476739 ] [ 1.1587992 3.7843983 4.9176951 ] [ 4.6585529 1.7706832 3.0946651 ] [ 4.4097184 4.514109 2.5564307 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9758303e-10 1.7523346e-10 1.8833081e-10 ] [ 2.3682681e-10 1.2566013e-10 4.7582011e-10 ] [ 1.6340161e-10 4.4541657e-10 2.2476739e-10 ] [ 1.1587992e-10 3.7843983e-10 4.9176951e-10 ] [ 4.6585529e-10 1.7706832e-10 3.0946651e-10 ] [ 4.4097184e-10 4.514109000000001e-10 2.5564307e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.9e-06 1.86e-05 2.33e-05 ] [ -1.84e-05 3e-07 9e-06 ] [ 3.5e-06 2.19e-05 -2.88e-05 ] [ 1.51e-05 -2.78e-05 6e-07 ] [ 2.05e-05 -8.5e-06 -1.4e-06 ] [ -2.46e-05 -4.5e-06 -2.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.248488872599999e-15 2.98004853924e-14 3.733071557219999e-14 ] [ -2.94800500656e-14 4.806529901999999e-16 1.4419589706e-14 ] [ 5.607618218999999e-15 3.50876682846e-14 -4.614268705919999e-14 ] [ 2.41928671734e-14 -4.454051042519999e-14 9.613059803999998e-16 ] [ 3.2844620997e-14 -1.3618501389e-14 -2.2430472876e-15 ] [ -3.94135451964e-14 -7.209794853e-15 -4.3258769118e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.691321 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.514026786279351e-18 } }