{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.889016 4.339495 1.275975 ] [ 2.554838 3.101562 2.999193 ] [ 4.055705 3.657127 1.332404 ] [ 4.476672 4.505138 3.486766 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.889016e-10 4.339495e-10 1.275975e-10 ] [ 2.554838e-10 3.101562e-10 2.999193e-10 ] [ 4.055705e-10 3.657127e-10 1.332404e-10 ] [ 4.476672e-10 4.505138e-10 3.486766e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.085367 1.2975686 -1.8712158 ] [ -0.2159729 -1.1339764 2.8277777 ] [ 2.2007758 0.093533 -1.3464286 ] [ 0.1005642 -0.2571253 0.3898667 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.341126253187834e-09 2.078934074804187e-09 -2.998018207231569e-09 ] [ -3.460267311063764e-10 -1.816830476618949e-09 4.530599319759596e-09 ] [ 3.526031534382417e-09 1.498563858732864e-10 -2.157216424496475e-09 ] [ 1.611216101294554e-10 -4.119601442761862e-10 6.246353119684473e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -9.5453813 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.529338675548151e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7609898 4.1791263 1.0932222 ] [ 2.5058868 3.2640781 3.1536661 ] [ 4.1062424 3.8611317 1.2836621 ] [ 4.6031119 4.298986 3.5637876 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7609898e-10 4.1791263e-10 1.0932222e-10 ] [ 2.5058868e-10 3.2640781e-10 3.1536661e-10 ] [ 4.1062424e-10 3.8611317e-10 1.2836621e-10 ] [ 4.6031119e-10 4.298986000000001e-10 3.5637876e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7e-06 1.95e-05 3.75e-05 ] [ -2.79e-05 -2.95e-05 -2.63e-05 ] [ 4.7e-06 -3.92e-05 -7.03e-05 ] [ 1.62e-05 4.92e-05 5.9e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.12152363456e-14 3.12424441056e-14 6.008162327999999e-14 ] [ -4.470072772032e-14 -4.72642103136e-14 -4.213724512704e-14 ] [ 7.53023011776e-15 -6.280532353535999e-14 -1.1263301644224e-13 ] [ 2.595526125696e-14 7.882708974336e-14 9.45284206272e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.026357 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.606399477719443e-18 } }