{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.44445e-10 0.0 0.0 ] "source-value" [ 5.44445 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.67308e-11 5.39053e-10 0.0 ] "source-value" [ 0.167308 5.39053 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.77721e-13 6.71422e-12 5.23553e-10 ] "source-value" [ 0.00577721 0.0671422 5.23553 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -2.01257416221792e-10 -3.056821614003494e-10 9.45616962334374e-09 ] [ -2.705397310079305e-09 3.768936730773594e-09 -7.679709992127398e-09 ] [ -7.531154573670202e-10 -7.46638337942112e-11 3.297983802448904e-09 ] [ -6.662675510246112e-09 4.115943353101252e-09 -1.21738572302812e-08 ] [ 2.223707395130323e-10 -3.171290404417847e-09 4.172497784550562e-09 ] [ 1.285538134795972e-09 1.243755771790439e-09 -5.699333331498737e-09 ] [ 3.819959166786605e-09 -1.00576650188133e-08 8.696404171694427e-09 ] [ 4.994577813036283e-09 4.480665722978081e-09 -7.015482813029376e-11 ] ] "source-value" [ [ -0.125615 -0.1907918 5.9020769 ] [ -1.6885762 2.3523853 -4.793298 ] [ -0.4700577 -0.0466015 2.0584396 ] [ -4.158515 2.5689698 -7.5983241 ] [ 0.1387929 -1.9793638 2.6042683 ] [ 0.8023698 0.7762913 -3.5572441 ] [ 2.384231 -6.2775008 5.4278686 ] [ 3.1173703 2.7966116 -0.0437872 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -6.63122e-12 1.14884e-11 -5.48352e-11 ] [ 1.65266e-10 1.49476e-10 1.67932e-10 ] [ 1.54179e-12 2.74054e-10 2.60324e-10 ] [ 1.52833e-10 4.11061e-10 4.06642e-10 ] [ 2.733690000000001e-10 5.15698e-12 2.61947e-10 ] [ 3.807380000000001e-10 1.47511e-10 4.06717e-10 ] [ 2.81179e-10 3.14543e-10 -2.04063e-11 ] [ 4.02065e-10 4.01269e-10 1.26672e-10 ] ] "source-value" [ [ -0.0663122 0.114884 -0.548352 ] [ 1.65266 1.49476 1.67932 ] [ 0.0154179 2.74054 2.60324 ] [ 1.52833 4.11061 4.06642 ] [ 2.73369 0.0515698 2.61947 ] [ 3.80738 1.47511 4.06717 ] [ 2.81179 3.14543 -0.204063 ] [ 4.02065 4.01269 1.26672 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.343448447982021e-18 "source-value" -20.868164 } }