{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.59774 0 0 ] "si-unit" "m" "si-value" [ 5.597740000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.20689 5.51351 0 ] "si-unit" "m" "si-value" [ -2.0689e-11 5.513510000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.513105 0.215809 5.94806 ] "si-unit" "m" "si-value" [ 5.131050000000001e-11 2.15809e-11 5.94806e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00246673 -0.00144352 -0.0330248 ] [ 1.48237 1.24989 1.2555 ] [ 0.11896 2.3805 2.33914 ] [ 1.62926 4.22989 4.16904 ] [ 2.92639 0.137476 2.28463 ] [ 4.54625 1.57381 3.68026 ] [ 3.00188 2.71108 0.0736878 ] [ 4.22934 4.27512 1.23802 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.46673e-13 -1.44352e-13 -3.30248e-12 ] [ 1.48237e-10 1.24989e-10 1.2555e-10 ] [ 1.1896e-11 2.3805e-10 2.33914e-10 ] [ 1.62926e-10 4.22989e-10 4.16904e-10 ] [ 2.92639e-10 1.37476e-11 2.28463e-10 ] [ 4.54625e-10 1.57381e-10 3.68026e-10 ] [ 3.00188e-10 2.71108e-10 7.36878e-12 ] [ 4.22934e-10 4.27512e-10 1.23802e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.8211072 0.8840061 -4.2902055 ] [ 0.2838142 0.435908 -3.934038 ] [ 0.1368244 5.9019694 1.1495721 ] [ 0.2655513 -0.1407946 0.5370886 ] [ 2.1871218 -1.7915426 4.7646612 ] [ -2.5072274 -2.2666043 4.3743511 ] [ -1.5493477 -0.3482997 -3.652458 ] [ -0.6378438 -2.6746423 1.0510285 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.91773537981055e-09 1.416333906064587e-09 -6.873666950527575e-09 ] [ 4.547204758910554e-10 6.984016064196864e-10 -6.30302370893879e-09 ] [ 2.192168548349875e-10 9.455997389357002e-09 1.84181754254396e-09 ] [ 4.25460084483047e-10 -2.255778164548877e-10 8.60510798218203e-10 ] [ 3.504155414802013e-09 -2.870367668887246e-09 7.633828780672873e-09 ] [ -4.01702112330917e-09 -3.631500418064749e-09 7.008483063590763e-09 ] [ -2.482328662430252e-09 -5.580376363716537e-10 -5.851882816053927e-09 ] [ -1.021938424082231e-09 -4.28524936206274e-09 1.683933290494493e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -29.207586 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.679571143920539e-18 } }