{ "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" [ [ 1.743709 2.680969 1.034902 ] [ 2.749822 1.528948 3.390438 ] [ 1.938557 3.742026 2.98984 ] [ 3.932402 1.721019 1.334077 ] [ 5.171354 1.721023 3.429234 ] [ 4.220666 3.803748 1.650722 ] [ 4.237092 3.532846 4.042988 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.743709e-10 2.680969e-10 1.034902e-10 ] [ 2.749822e-10 1.528948e-10 3.390438e-10 ] [ 1.938557e-10 3.742026e-10 2.98984e-10 ] [ 3.932402e-10 1.721019e-10 1.334077e-10 ] [ 5.171354e-10 1.721023e-10 3.429234e-10 ] [ 4.220666e-10 3.803748e-10 1.650722e-10 ] [ 4.237092e-10 3.532846e-10 4.042988e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.9345161 -0.4967908 -0.1451523 ] [ -0.0751655 0.4043009 0.1077748 ] [ 1.3551588 0.2705534 0.8671889 ] [ -0.3262488 -2.683338 -0.633605 ] [ 0.5606447 -1.8008759 -1.2215562 ] [ -0.3732867 2.3382674 1.0180215 ] [ -2.0756186 1.967883 0.0073285 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.497259847181195e-09 -7.959466051885286e-10 -2.325596215153478e-10 ] [ -1.204284067907424e-10 6.477614497483988e-10 1.726742648713958e-10 ] [ 2.171203746831383e-09 4.334743321579507e-10 1.389389781397269e-09 ] [ -5.227081999240551e-10 -4.29918140930423e-09 -1.015147117821984e-09 ] [ 8.982518309154298e-10 -2.885321263942159e-09 -1.957148784633289e-09 ] [ -5.980712235955834e-10 3.746317361458802e-09 1.631050246771747e-09 ] [ -3.325507594617627e-09 3.152896135069767e-09 1.17415513655328e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -8.481053085572459 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.35881449734679e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0273426 2.6192394 1.1978435 ] [ 2.7430123 1.6507551 3.3033255 ] [ 2.051318 3.9622523 3.0548783 ] [ 3.9385512 1.3543823 1.2138273 ] [ 5.1437269 1.9156853 3.0807342 ] [ 4.1123058 3.7008346 1.8030195 ] [ 3.9773452 3.5274301 4.2185726 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0273426e-10 2.6192394e-10 1.1978435e-10 ] [ 2.7430123e-10 1.6507551e-10 3.3033255e-10 ] [ 2.051318e-10 3.9622523e-10 3.0548783e-10 ] [ 3.9385512e-10 1.3543823e-10 1.2138273e-10 ] [ 5.1437269e-10 1.9156853e-10 3.0807342e-10 ] [ 4.1123058e-10 3.7008346e-10 1.8030195e-10 ] [ 3.9773452e-10 3.5274301e-10 4.2185726e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.9e-06 -1.53e-05 2.49e-05 ] [ -2.12e-05 3.7e-05 -2.34e-05 ] [ -4.8e-06 -2e-05 5.1e-06 ] [ 1.7e-05 3.8e-06 1.39e-05 ] [ -3.7e-06 -1.26e-05 -4.5e-06 ] [ 8.2e-06 1.6e-05 -6.5e-06 ] [ 6.4e-06 -9.1e-06 -9.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.04413557952e-15 -2.451330229824e-14 3.989419785791999e-14 ] [ -3.396614436096001e-14 5.92805349696e-14 -3.749093292672001e-14 ] [ -7.69044777984e-15 -3.2043532416e-14 8.17110076608e-15 ] [ 2.72370025536e-14 6.08827115904e-15 2.227025502912e-14 ] [ -5.928053496960001e-15 -2.018742542208e-14 -7.2097947936e-15 ] [ 1.313784829056e-14 2.56348259328e-14 -1.04141480352e-14 ] [ 1.025393037312e-14 -1.457980724928e-14 -1.490024257344e-14 ] ] } "relaxed-potential-energy" { "source-value" -9.821491085572458 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.573576339869981e-18 } }