{ "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" [ [ 2.4718 1.858527 2.216013 ] [ 2.961187 3.9638 1.175243 ] [ 2.62986 4.035161 3.548452 ] [ 4.200659 2.412747 0.4103634 ] [ 4.64949 3.303863 2.581344 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4718e-10 1.858527e-10 2.216013e-10 ] [ 2.961187e-10 3.9638e-10 1.175243e-10 ] [ 2.62986e-10 4.035161000000001e-10 3.548452e-10 ] [ 4.200659e-10 2.412747e-10 4.103634e-11 ] [ 4.64949e-10 3.303863e-10 2.581344e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.1401453 -7.9011327 1.9007309 ] [ -5.1016363 7.9706207 -6.3473295 ] [ -2.2938347 2.3750286 4.9084621 ] [ 3.6126984 -3.6946837 -5.9964255 ] [ 9.9229178 1.2501671 5.534562 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.837597247975004e-09 -1.265901008977838e-08 3.045306610412142e-09 ] [ -8.173722407684616e-09 1.277034213880453e-08 -1.016954292941415e-08 ] [ -3.675128328319782e-09 3.805215296651354e-09 7.864223220702872e-09 ] [ 5.788180914481568e-09 -5.919535845390841e-09 -9.607332744468952e-09 ] [ 1.589826690928017e-08 2.002988499713336e-09 8.86734584276809e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -2.7223041 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.361611983727986e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.3931433 1.6107032 2.2999599 ] [ 2.7257362 4.4309803 0.901832 ] [ 2.7182614 3.8122948 3.2351806 ] [ 4.0469379 2.4173447 0.7373856 ] [ 5.0289172 3.302775 2.7570572 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3931433e-10 1.6107032e-10 2.2999599e-10 ] [ 2.7257362e-10 4.4309803e-10 9.01832e-11 ] [ 2.7182614e-10 3.8122948e-10 3.2351806e-10 ] [ 4.0469379e-10 2.4173447e-10 7.373856e-11 ] [ 5.0289172e-10 3.302775e-10 2.7570572e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.8e-06 -0.0 7e-07 ] [ 1.8e-06 9e-07 -4e-07 ] [ -4e-07 -1.1e-06 -4e-07 ] [ -1.5e-06 5e-07 1.4e-06 ] [ -1.6e-06 -2e-07 -1.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.88391791744e-15 0.0 1.12152363456e-15 ] [ 2.88391791744e-15 1.44195895872e-15 -6.408706483200001e-16 ] [ -6.408706483200001e-16 -1.76239428288e-15 -6.408706483200001e-16 ] [ -2.4032649312e-15 8.010883104e-16 2.24304726912e-15 ] [ -2.56348259328e-15 -3.2043532416e-16 -1.92261194496e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.3509582 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.337970998931805e-18 } }