{ "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" [ [ 2.009011 2.631584 2.068402 ] [ 2.205606 1.805457 4.240805 ] [ 0.8880067 3.587298 3.588265 ] [ 4.034619 2.466924 2.718393 ] [ 3.26703 4.599532 3.000235 ] [ 4.036538 3.227395 4.622039 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.009011e-10 2.631584e-10 2.068402e-10 ] [ 2.205606e-10 1.805457e-10 4.240805e-10 ] [ 8.880067e-11 3.587298e-10 3.588265e-10 ] [ 4.034619000000001e-10 2.466924e-10 2.718393e-10 ] [ 3.26703e-10 4.599532e-10 3.000235e-10 ] [ 4.036538e-10 3.227395e-10 4.622039e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.6698324 -4.1798401 -14.8325741 ] [ -4.9550451 -10.8775965 10.4506616 ] [ -7.8856578 5.1000954 3.5862464 ] [ 12.3101798 -7.6055214 -9.6422716 ] [ 1.2960239 15.2684846 -2.4316069 ] [ 5.9043315 2.294378 12.8695446 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.068624953593435e-08 -6.696842086902334e-09 -2.37644034493036e-08 ] [ -7.9388574142296e-09 -1.742783080279591e-08 1.674380568741232e-08 ] [ -1.263421656678916e-08 8.171253613729624e-09 5.745800138508166e-09 ] [ 1.972308227340442e-08 -1.218538857607408e-08 -1.544862212892381e-08 ] [ 2.076459192578037e-09 2.446280906116484e-08 -3.895863726155963e-09 ] [ 9.459781890752996e-09 3.675998790877862e-09 2.061928347846289e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -2.0981343 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.361581722758573e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.9999946 2.2369076 1.643349 ] [ 1.9595149 2.0707808 4.9054769 ] [ 1.0522316 3.6296967 3.3051557 ] [ 4.2934178 2.3568044 2.2292662 ] [ 3.0050926 4.9943322 3.6627942 ] [ 4.1305592 3.0296683 4.4920971 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9999946e-10 2.2369076e-10 1.643349e-10 ] [ 1.9595149e-10 2.0707808e-10 4.9054769e-10 ] [ 1.0522316e-10 3.6296967e-10 3.3051557e-10 ] [ 4.293417800000001e-10 2.3568044e-10 2.2292662e-10 ] [ 3.0050926e-10 4.9943322e-10 3.6627942e-10 ] [ 4.1305592e-10 3.0296683e-10 4.4920971e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.22e-05 3e-07 -6.4e-06 ] [ -2.28e-05 1.92e-05 2.4e-05 ] [ 1.5e-06 2e-06 1.74e-05 ] [ -1.98e-05 8e-07 -3.8e-06 ] [ -1.75e-05 -7.6e-06 7.2e-06 ] [ 6.4e-06 -1.46e-05 -3.83e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.363361960576001e-14 4.8065298624e-16 -1.025393037312e-14 ] [ -3.652962695424e-14 3.076179111936e-14 3.84522388992e-14 ] [ 2.4032649312e-15 3.2043532416e-15 2.787787320192e-14 ] [ -3.172309709184e-14 1.28174129664e-15 -6.08827115904e-15 ] [ -2.8038090864e-14 -1.217654231808e-14 1.153567166976e-14 ] [ 1.025393037312e-14 -2.339177866368e-14 -6.136336457664001e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.125717 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.263189352943711e-18 } }