{ "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" [ [ 1.797173 1.880519 2.621604 ] [ 2.732492 2.231734 4.550403 ] [ 1.229923 3.945183 3.396256 ] [ 3.798537 2.960677 2.455754 ] [ 3.373455 4.934702 3.584472 ] [ 4.913806 3.358248 4.34106 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.797173e-10 1.880519e-10 2.621604e-10 ] [ 2.732492e-10 2.231734e-10 4.550403000000001e-10 ] [ 1.229923e-10 3.945183e-10 3.396256e-10 ] [ 3.798537e-10 2.960677e-10 2.455754e-10 ] [ 3.373455e-10 4.934702e-10 3.584472e-10 ] [ 4.913806e-10 3.358248e-10 4.34106e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.5352922 -12.8011367 -9.7720308 ] [ -1.844064 -9.5871146 15.5143932 ] [ -14.8183068 8.4571557 0.3422599 ] [ 9.1630573 -3.2195577 -15.7632345 ] [ 1.7140995 17.3432297 0.9709716 ] [ 15.3205062 -0.1925764 8.7076406 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.52772222353366e-08 -2.050968194040487e-08 -1.565651928549752e-08 ] [ -2.954516228058931e-09 -1.536025087305034e-08 2.48567980709385e-08 ] [ -2.374154471480166e-08 1.354985714100546e-08 5.483608100173459e-10 ] [ 1.468083618111077e-08 -5.15830007625662e-09 -2.525548578408798e-08 ] [ 2.74629014462497e-09 2.77869171545042e-08 1.55566799698077e-09 ] [ 2.454615685246145e-08 -3.085414057978291e-10 1.395117819164888e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 68.345004 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.095007675572825e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.4413234 -0.0600042 1.3593296 ] [ 2.2011532 1.1860136 6.4311203 ] [ -0.9725152 4.7991842 3.5132441 ] [ 5.0282321 2.8443143 0.4696697 ] [ 3.9353181 7.2771459 3.6644964 ] [ 7.2118745 3.2644091 5.5116889 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.413234e-11 -6.00042e-12 1.3593296e-10 ] [ 2.2011532e-10 1.1860136e-10 6.4311203e-10 ] [ -9.725152000000001e-11 4.7991842e-10 3.5132441e-10 ] [ 5.028232100000001e-10 2.8443143e-10 4.696697e-11 ] [ 3.9353181e-10 7.2771459e-10 3.6644964e-10 ] [ 7.211874500000001e-10 3.2644091e-10 5.511688900000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0 -0.0 -0.0 ] [ 0.0 0.0 0.0 ] [ -0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 -0.0 ] [ 0.0 -0.0 0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" 8.8817842e-16 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.423018699623083e-34 } }