{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.5417e-10 0.0 0.0 ] "source-value" [ 5.5417 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -8.77832e-12 5.55439e-10 0.0 ] "source-value" [ -0.0877832 5.55439 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 3.08884e-12 4.074500000000001e-12 5.63916e-10 ] "source-value" [ 0.0308884 0.040745 5.63916 ] } "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" [ [ 2.626300574010664e-09 1.780334976026732e-09 -1.989382815849502e-09 ] [ -1.143086688828699e-09 -1.471142605867872e-10 -7.774299295466189e-10 ] [ -1.510856238420628e-09 -6.341288493173356e-10 -2.153517639549696e-09 ] [ 2.174576649053491e-10 2.496508566394981e-09 2.331428778923839e-09 ] [ 1.110855701748065e-09 -1.375573251090138e-09 1.117693150694991e-09 ] [ 7.34553760562066e-10 -1.712967614781306e-09 -1.233005166664871e-09 ] [ -1.301629275251652e-09 2.978677051500595e-10 -4.310701059207782e-10 ] [ -7.335953385075035e-10 -7.049272717962048e-10 3.135283727912636e-09 ] ] "source-value" [ [ 1.6392079 1.1111977 -1.2416751 ] [ -0.7134586 -0.0918215 -0.4852336 ] [ -0.9430023 -0.3957921 -1.34412 ] [ 0.1357264 1.5581981 1.4551634 ] [ 0.6933416 -0.8585653 0.6976092 ] [ 0.4584724 -1.0691503 -0.7695813 ] [ -0.8124131 0.1859144 -0.2690528 ] [ -0.4578742 -0.439981 1.9568902 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -1.59411e-11 -8.747230000000001e-12 -7.74134e-13 ] [ 1.28203e-10 1.40365e-10 1.4018e-10 ] [ -7.44566e-12 2.77196e-10 2.86869e-10 ] [ 1.41795e-10 4.01233e-10 4.00515e-10 ] [ 2.72183e-10 1.05785e-11 2.67146e-10 ] [ 4.038e-10 1.47487e-10 4.29534e-10 ] [ 2.69485e-10 2.74872e-10 1.00738e-12 ] [ 4.0446e-10 4.150070000000001e-10 1.27967e-10 ] ] "source-value" [ [ -0.159411 -0.0874723 -0.00774134 ] [ 1.28203 1.40365 1.4018 ] [ -0.0744566 2.77196 2.86869 ] [ 1.41795 4.01233 4.00515 ] [ 2.72183 0.105785 2.67146 ] [ 4.038 1.47487 4.29534 ] [ 2.69485 2.74872 0.0100738 ] [ 4.0446 4.15007 1.27967 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.71332017318066e-18 "source-value" -35.65974 } }