{ "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" [ [ 2.648062 2.256008 1.840542 ] [ 2.082623 2.792532 4.589039 ] [ 1.893054 0.6019814 4.219017 ] [ 3.79314 0.2675402 2.698761 ] [ 5.137376 2.400602 1.294264 ] [ 4.215429 1.396012 4.868853 ] [ 4.085322 3.344134 3.585876 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.648062e-10 2.256008e-10 1.840542e-10 ] [ 2.082623e-10 2.792532e-10 4.589039e-10 ] [ 1.893054e-10 6.019814000000001e-11 4.219017e-10 ] [ 3.79314e-10 2.675402e-11 2.698761000000001e-10 ] [ 5.137376e-10 2.400602e-10 1.294264e-10 ] [ 4.215429000000001e-10 1.396012e-10 4.868853e-10 ] [ 4.085322e-10 3.344134e-10 3.585876e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.1635047 1.0487411 -5.6315304 ] [ -6.0784029 4.4647943 3.2456157 ] [ -5.1145635 -4.5616487 1.6705374 ] [ 1.2779658 -5.1344864 -2.3163124 ] [ 1.8362409 0.3761258 -1.4435038 ] [ 6.6326129 -2.312305 3.9824739 ] [ 3.6096515 6.1187789 0.4927197 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.466316649330917e-09 1.680268471692075e-09 -9.022706346204472e-09 ] [ -9.738675018182921e-09 7.153389044141102e-09 5.200049594641427e-09 ] [ -8.19443406529702e-09 -7.308566899442713e-09 2.676495966452018e-09 ] [ 2.047526926941969e-09 -8.226354069895558e-09 -3.711141573749138e-09 ] [ 2.941982240136751e-09 6.026199632396967e-10 -2.312748040395959e-09 ] [ 1.062661732319649e-08 -3.704721011158944e-09 6.380626575526198e-09 ] [ 5.783299242535651e-09 9.80336450142434e-09 7.894239839475898e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -4.8263704 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.732697818201145e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.7993062 1.7960696 1.5372553 ] [ 1.9519299 2.9561612 3.7134636 ] [ 1.5822877 0.7087038 4.5607231 ] [ 3.3655879 -0.048264 3.0911615 ] [ 4.7191419 3.2767872 1.702366 ] [ 5.0671206 1.0448109 4.3831166 ] [ 4.3696316 3.3245409 4.1082658 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7993062e-10 1.7960696e-10 1.5372553e-10 ] [ 1.9519299e-10 2.9561612e-10 3.7134636e-10 ] [ 1.5822877e-10 7.087038e-11 4.5607231e-10 ] [ 3.3655879e-10 -4.826400000000001e-12 3.0911615e-10 ] [ 4.7191419e-10 3.2767872e-10 1.702366e-10 ] [ 5.0671206e-10 1.0448109e-10 4.3831166e-10 ] [ 4.3696316e-10 3.3245409e-10 4.1082658e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.16e-05 -2.09e-05 1.88e-05 ] [ 1.5e-06 2e-07 7.6e-06 ] [ -5.3e-06 -8e-06 -1e-05 ] [ -3.3e-06 -9.8e-06 -2.2e-06 ] [ 2.46e-05 1.1e-06 8.3e-06 ] [ -2.48e-05 4.68e-05 -3.01e-05 ] [ 1.89e-05 -9.4e-06 7.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.858524880128e-14 -3.348549137472e-14 3.012092047104e-14 ] [ 2.4032649312e-15 3.2043532416e-16 1.217654231808e-14 ] [ -8.491536090240001e-15 -1.28174129664e-14 -1.6021766208e-14 ] [ -5.28718284864e-15 -1.570133088384e-14 -3.52478856576e-15 ] [ 3.941354487168e-14 1.76239428288e-15 1.329806595264e-14 ] [ -3.973398019584e-14 7.498186585344001e-14 -4.822551628608e-14 ] [ 3.028113813312e-14 -1.506046023552e-14 1.217654231808e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.129296 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.783109785716296e-18 } }