{ "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" [ [ 0.3288529 1.174724 0.8712814 ] [ 1.395659 1.176494 2.521247 ] [ 2.395391 0.4245255 0.3168768 ] [ 2.017962 2.536207 0.5333854 ] [ 2.744316 1.992854 1.84914 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.288529e-11 1.174724e-10 8.712814e-11 ] [ 1.395659e-10 1.176494e-10 2.521247e-10 ] [ 2.395391e-10 4.245255e-11 3.168768e-11 ] [ 2.017962e-10 2.536207e-10 5.333854e-11 ] [ 2.744316e-10 1.992854e-10 1.84914e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -16.0437921 -2.9741142 -7.4189425 ] [ -13.7361828 -11.4717935 22.5099231 ] [ 5.2508051 -12.1638915 -8.037599 ] [ -10.2441718 22.5252073 -29.6316126 ] [ 34.7733416 4.0845918 22.578231 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.570498861159574e-08 -4.765056238829294e-09 -1.18864562245595e-08 ] [ -2.200779094119508e-08 -1.837983934434541e-08 3.606487252682586e-08 ] [ 8.412717171597407e-09 -1.948870257924785e-08 -1.287765320516546e-08 ] [ -1.641297255741866e-08 3.60893605147335e-08 -4.74750769443227e-08 ] [ 5.571303493861207e-08 6.544237487471389e-09 3.61743138472218e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 4.0858549 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.546261196761123e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.0030255 0.9719991 0.4576662 ] [ 1.2364769 1.2596106 2.6065738 ] [ 2.4083453 0.3119396 0.4838089 ] [ 1.6844859 2.8113315 0.5647754 ] [ 3.5498473 1.9499237 1.9791063 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.0255e-13 9.719991000000001e-11 4.576662e-11 ] [ 1.2364769e-10 1.2596106e-10 2.6065738e-10 ] [ 2.4083453e-10 3.119396e-11 4.838089e-11 ] [ 1.6844859e-10 2.8113315e-10 5.647754e-11 ] [ 3.5498473e-10 1.9499237e-10 1.9791063e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.11e-05 -3.4e-06 -3.4e-06 ] [ 1.6e-06 1.6e-06 7e-06 ] [ 1.06e-05 -2.1e-06 1e-07 ] [ 3.3e-06 8.3e-06 -8e-07 ] [ -4.4e-06 -4.4e-06 -2.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.778416049088e-14 -5.44740051072e-15 -5.44740051072e-15 ] [ 2.56348259328e-15 2.56348259328e-15 1.12152363456e-14 ] [ 1.698307218048e-14 -3.36457090368e-15 1.6021766208e-16 ] [ 5.28718284864e-15 1.329806595264e-14 -1.28174129664e-15 ] [ -7.04957713152e-15 -7.04957713152e-15 -4.48609453824e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.840953 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.538000454779163e-18 } }