{ "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" [ [ 2.941384 3.398999 4.495714 ] [ 5.079285 2.89491 3.814281 ] [ 5.144035 3.811985 1.647129 ] [ 3.115427 4.213177 2.153983 ] [ 4.243195 5.045313 3.693161 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.941384e-10 3.398999e-10 4.495714000000001e-10 ] [ 5.079285e-10 2.89491e-10 3.814281e-10 ] [ 5.144035e-10 3.811985e-10 1.647129e-10 ] [ 3.115427e-10 4.213177e-10 2.153983e-10 ] [ 4.243195e-10 5.045313e-10 3.693161e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.961403 -2.7946194 2.8666063 ] [ 3.8353166 -4.0309548 1.1265197 ] [ 6.2124249 -1.7076063 -4.7357213 ] [ -9.9897399 -1.6331997 -5.5010848 ] [ 4.9034014 10.1663801 6.24368 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.9490439584575e-09 -4.477473903603099e-09 4.592809632737193e-09 ] [ 6.144854640512324e-09 -6.458301593270143e-09 1.80488354108069e-09 ] [ 9.953402015259786e-09 -2.735886913931194e-09 -7.587462011996103e-09 ] [ -1.600532784751749e-08 -2.61667439799581e-09 -8.813709528212564e-09 ] [ 7.856115150202886e-09 1.628833664858258e-08 1.000347820617312e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -6.2759793 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.005522738992768e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8516662 3.1965518 4.3036391 ] [ 5.3045679 3.1764244 3.7782699 ] [ 5.0807942 3.2126863 1.378364 ] [ 3.1315657 4.4158672 2.1292274 ] [ 4.154732 5.3628542 4.2147676 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8516662e-10 3.1965518e-10 4.3036391e-10 ] [ 5.3045679e-10 3.1764244e-10 3.7782699e-10 ] [ 5.0807942e-10 3.2126863e-10 1.378364e-10 ] [ 3.1315657e-10 4.4158672e-10 2.1292274e-10 ] [ 4.154732e-10 5.3628542e-10 4.2147676e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.04e-05 4.6e-06 -2.9e-06 ] [ 3.82e-05 -8.04e-05 -4.03e-05 ] [ -1.16e-05 -5.49e-05 -1.53e-05 ] [ -9.1e-06 -1.17e-05 -9.34e-05 ] [ -5.78e-05 0.0001424 0.0001519 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.472793601359999e-14 7.370012516399999e-15 -4.6463122386e-15 ] [ 6.12031474188e-14 -1.288150013736e-13 -6.456771835019998e-14 ] [ -1.85852489544e-14 -8.795949720659999e-14 -2.45133025002e-14 ] [ -1.45798073694e-14 -1.87454666178e-14 -1.496432976156e-13 ] [ -9.26058094452e-14 2.281499526816e-13 2.433706307046e-13 ] ] } "relaxed-potential-energy" { "source-value" -10.674822 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.710295038050915e-18 } }