{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.384535 1.809355 2.901981 ] [ 1.948299 3.967012 2.633856 ] [ 1.645033 3.274995 4.707865 ] [ 4.440095 1.758867 2.666287 ] [ 3.649735 2.240012 5.07701 ] [ 4.164388 4.024114 1.736165 ] [ 3.303688 4.596831 4.046686 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.384535e-10 1.809355e-10 2.901981e-10 ] [ 1.948299e-10 3.967012e-10 2.633856000000001e-10 ] [ 1.645033e-10 3.274995e-10 4.707865e-10 ] [ 4.440095e-10 1.758867e-10 2.666287e-10 ] [ 3.649735e-10 2.240012e-10 5.07701e-10 ] [ 4.164388e-10 4.024114e-10 1.736165e-10 ] [ 3.303688e-10 4.596831e-10 4.046686e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -68.8132547 -9.5699051 -0.3451701 ] [ -49.6239487 -10.6254273 -74.6925914 ] [ -36.4045627 -15.5693368 34.8955569 ] [ 67.6908325 -0.4518674 -7.6899 ] [ 12.8865863 -5.5251098 5.7947316 ] [ 3.5786334 0.0798445 -0.652774 ] [ 70.6857139 41.6618019 42.6901469 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.102509887898307e-07 -1.533267834081743e-08 -5.530234689754433e-10 ] [ -7.950633109395466e-08 -1.702381134632571e-08 -1.196707246739893e-07 ] [ -5.832653972892795e-08 -2.494482762783633e-08 5.590884589559747e-08 ] [ 1.084526701675078e-07 -7.239713899463315e-10 -1.23205780977966e-08 ] [ 2.064658746188451e-08 -8.852201821844413e-09 9.284183569821435e-09 ] [ 5.733602815131975e-09 1.27924992253413e-10 -1.045859250082716e-09 ] [ 1.13250999168189e-07 6.67495655345168e-08 6.839715586520753e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 9.3221142 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.49356735507196e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0649711 1.4712706 3.0104556 ] [ 1.7540781 4.0017936 2.2813783 ] [ 1.3449495 3.3113177 4.8816726 ] [ 4.6389463 1.6998977 2.5351517 ] [ 3.8522897 2.2580548 4.9791545 ] [ 4.3391121 4.1402822 1.831997 ] [ 3.5414263 4.7885695 4.2500402 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0649711e-10 1.4712706e-10 3.0104556e-10 ] [ 1.7540781e-10 4.0017936e-10 2.2813783e-10 ] [ 1.3449495e-10 3.3113177e-10 4.8816726e-10 ] [ 4.6389463e-10 1.6998977e-10 2.5351517e-10 ] [ 3.8522897e-10 2.2580548e-10 4.9791545e-10 ] [ 4.339112100000001e-10 4.1402822e-10 1.831997e-10 ] [ 3.5414263e-10 4.788569500000001e-10 4.2500402e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.04e-05 3.3e-06 -2e-06 ] [ 4.47e-05 -5.05e-05 -7.6e-06 ] [ 5.6e-06 4.2e-05 -2.2e-06 ] [ -7.88e-05 8.62e-05 1.07e-05 ] [ 1.28e-05 7e-07 -2.05e-05 ] [ -5.7e-06 -2.16e-05 1.17e-05 ] [ -9e-06 -6.01e-05 9.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.870616967359999e-14 5.2871828922e-15 -3.204353268e-15 ] [ 7.16172955398e-14 -8.090992001699999e-14 -1.21765424184e-14 ] [ 8.972189150399999e-15 6.729141862799998e-14 -3.5247885948e-15 ] [ -1.262515187592e-13 1.381076258508e-13 1.71432899838e-14 ] [ 2.05078609152e-14 1.1215236438e-15 -3.2844620997e-14 ] [ -9.1324068138e-15 -3.46070152944e-14 1.87454666178e-14 ] [ -1.4419589706e-14 -9.629081570339999e-14 1.55411133498e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.900855 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.989556804762207e-18 } }