{ "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" [ [ 0.7145242 0.8187554 1.873184 ] [ 0.3169354 2.259423 0.2511792 ] [ 1.412151 2.902885 2.703929 ] [ 2.136626 0.3772665 0.2243012 ] [ 2.65148 2.117604 0.8383983 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.145242000000001e-11 8.187554e-11 1.873184e-10 ] [ 3.169354e-11 2.259423e-10 2.511792e-11 ] [ 1.412151e-10 2.902885e-10 2.703929e-10 ] [ 2.136626e-10 3.772665e-11 2.243012e-11 ] [ 2.65148e-10 2.117604e-10 8.383983000000001e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.0764384 -11.5975323 10.6675662 ] [ -12.0225606 7.6500464 -10.4997921 ] [ -0.0612384 9.8597918 11.9772042 ] [ 5.5495043 -15.5243719 -9.9826354 ] [ 15.610733 9.612066 -2.1623429 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.454205740461136e-08 -1.858129511003285e-08 1.70913251664763e-08 ] [ -1.926226551547122e-08 1.225672549011521e-08 -1.682252142588054e-08 ] [ -9.811473277519872e-11 1.579712790791555e-08 1.918959655178757e-08 ] [ 8.89128604648907e-09 -2.487278571078448e-08 -1.599394505185046e-08 ] [ 2.501115144615105e-08 1.540022742278657e-08 -3.464455240532872e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 53.778793 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.61631248394427e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.484191 -0.722976 3.2184406 ] [ -0.8634895 3.0579969 -0.8834853 ] [ 1.1677185 4.3876409 4.4048634 ] [ 2.6947653 -1.5631648 -1.1909649 ] [ 4.7169134 3.3164369 0.342138 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.84191e-11 -7.22976e-11 3.2184406e-10 ] [ -8.634895e-11 3.0579969e-10 -8.834853e-11 ] [ 1.1677185e-10 4.3876409e-10 4.4048634e-10 ] [ 2.6947653e-10 -1.5631648e-10 -1.1909649e-10 ] [ 4.7169134e-10 3.3164369e-10 3.42138e-11 ] ] } "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 ] ] "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 ] ] } "relaxed-potential-energy" { "source-value" -1.7763568e-15 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.846037335159101e-34 } }