{ "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" [ [ 2.430797 0.9143471 3.003228 ] [ 2.900858 2.600657 5.132587 ] [ 1.698571 3.470708 2.452381 ] [ 4.30988 2.177249 1.737833 ] [ 5.127339 2.024866 3.874492 ] [ 3.797222 3.704908 3.463102 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.430797e-10 9.143471e-11 3.003228e-10 ] [ 2.900858e-10 2.600657e-10 5.132587e-10 ] [ 1.698571e-10 3.470708e-10 2.452381e-10 ] [ 4.30988e-10 2.177249e-10 1.737833e-10 ] [ 5.127339e-10 2.024866e-10 3.874492e-10 ] [ 3.797222e-10 3.704908e-10 3.463102e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2938106 0.9038307 0.2113448 ] [ -12.3595475 -13.3536597 20.4570563 ] [ -4.6323984 -1.1556342 -2.5051157 ] [ -4.2154349 -6.0388446 -24.1473071 ] [ 28.667127 -27.2408497 21.800285 ] [ -7.1659355 46.8851577 -15.8162633 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.707364781415204e-10 1.448096428631864e-09 3.386117002774032e-10 ] [ -1.980217821131311e-08 -2.139492154972745e-08 3.27758176042825e-08 ] [ -7.421920475858985e-09 -1.851530112691283e-09 -4.013637840006554e-09 ] [ -6.753871298928126e-09 -9.675295714477076e-09 -3.86882512096423e-08 ] [ 4.592980104331052e-08 -4.36446528796459e-08 3.492790724154068e-08 ] [ -1.148109441885111e-08 7.511830414834518e-08 -2.534044749645173e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -7.6310075 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.222622191037875e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1049995 1.2967877 2.869409 ] [ 3.1409322 2.0550815 5.0978201 ] [ 1.2990811 3.6573822 2.3293873 ] [ 4.4379249 1.7654561 1.8937688 ] [ 5.5971162 2.1757763 4.2035416 ] [ 3.6846132 3.9422514 3.2696961 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1049995e-10 1.2967877e-10 2.869409e-10 ] [ 3.1409322e-10 2.0550815e-10 5.0978201e-10 ] [ 1.2990811e-10 3.6573822e-10 2.3293873e-10 ] [ 4.4379249e-10 1.7654561e-10 1.8937688e-10 ] [ 5.5971162e-10 2.1757763e-10 4.2035416e-10 ] [ 3.6846132e-10 3.9422514e-10 3.2696961e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.83e-05 1.88e-05 -0.0001037 ] [ -4.08e-05 6.31e-05 8.7e-05 ] [ -0.0001128 3.8e-06 2.46e-05 ] [ 5.7e-06 -3.71e-05 -3.61e-05 ] [ 7.65e-05 -2.02e-05 2.57e-05 ] [ 3.31e-05 -2.84e-05 2.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.13633650822e-14 3.012092071919999e-14 -1.661457169458e-13 ] [ -6.53688066672e-14 1.010973456054e-13 1.39389367158e-13 ] [ -1.807255243152e-13 6.088271209199999e-15 3.94135451964e-14 ] [ 9.1324068138e-15 -5.94407531214e-14 -5.783857648740001e-14 ] [ 1.22566512501e-13 -3.236396800679999e-14 4.11759394938e-14 ] [ 5.303204658539999e-14 -4.550181640559999e-14 4.005441585e-15 ] ] } "relaxed-potential-energy" { "source-value" -20.401793 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.268727603630476e-18 } }