{ "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" [ [ 0.8403174 0.0019487 1.613535 ] [ 0.0637823 2.769237 1.974876 ] [ 2.710551 0.627508 0.2521163 ] [ 2.357874 0.9595638 1.99039 ] [ 1.619464 1.82467 0.5389468 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.403174e-11 1.9487e-13 1.613535e-10 ] [ 6.37823e-12 2.769237e-10 1.974876e-10 ] [ 2.710551e-10 6.27508e-11 2.521163e-11 ] [ 2.357874e-10 9.595638e-11 1.99039e-10 ] [ 1.619464e-10 1.82467e-10 5.389467999999999e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -17.4546 -16.2703103 5.6987694 ] [ -4.1739 4.3710664 1.8085845 ] [ 21.0495784 -14.3125405 -19.6929541 ] [ 13.9583513 0.4555595 24.6646791 ] [ -13.3794297 25.7562251 -12.479079 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.796535204541568e-08 -2.606791077582143e-08 9.130435100010443e-09 ] [ -6.687324997557121e-09 7.003220394044422e-09 2.897671802641258e-09 ] [ 3.372514239017667e-08 -2.293121777335314e-08 -3.155159065350751e-08 ] [ 2.236374411777329e-08 7.298867802833376e-10 3.951717221355439e-08 ] [ -2.143620946497716e-08 4.126602169528214e-08 -1.999368862291625e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 17.872667 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.863516921874368e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5163608 0.4697181 2.8054638 ] [ -0.2247437 2.1765492 1.3986445 ] [ 3.215027 1.1296289 0.2504284 ] [ 2.6422075 -0.1773899 2.0957567 ] [ 1.443137 2.5844211 -0.1804293 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.163607999999999e-11 4.697181e-11 2.8054638e-10 ] [ -2.247437e-11 2.1765492e-10 1.3986445e-10 ] [ 3.215027e-10 1.1296289e-10 2.504284e-11 ] [ 2.6422075e-10 -1.773899e-11 2.0957567e-10 ] [ 1.443137e-10 2.5844211e-10 -1.804293e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8.1e-06 -5.3e-06 -5.2e-06 ] [ 3e-06 7.6e-06 -6.9e-06 ] [ -1.1e-05 -3e-06 7.3e-06 ] [ 4.7e-06 -1.9e-06 4.5e-06 ] [ -4.7e-06 2.5e-06 3e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.297763062848e-14 -8.491536090240001e-15 -8.33131842816e-15 ] [ 4.8065298624e-15 1.217654231808e-14 -1.105501868352e-14 ] [ -1.76239428288e-14 -4.8065298624e-15 1.169588933184e-14 ] [ 7.53023011776e-15 -3.04413557952e-15 7.2097947936e-15 ] [ -7.53023011776e-15 4.005441552e-15 4.8065298624e-16 ] ] } "relaxed-potential-energy" { "source-value" -7.4797183 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.198382979042992e-18 } }