{ "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" [ 5.46441 0 0 ] "si-unit" "m" "si-value" [ 5.46441e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.239301 5.60761 0 ] "si-unit" "m" "si-value" [ 2.39301e-11 5.60761e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.167861 -0.733416 5.71653 ] "si-unit" "m" "si-value" [ 1.67861e-11 -7.33416e-11 5.71653e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00327702 -0.0382766 0.433443 ] [ 1.09616 1.45225 1.46895 ] [ 0.130178 2.57242 2.88603 ] [ 1.56489 3.87283 4.50025 ] [ 2.74098 -0.214768 2.33093 ] [ 4.21449 1.24218 3.87733 ] [ 2.20243 2.94328 0.228142 ] [ 4.00805 4.02926 1.38377 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.27702e-13 -3.82766e-12 4.33443e-11 ] [ 1.09616e-10 1.45225e-10 1.46895e-10 ] [ 1.30178e-11 2.57242e-10 2.88603e-10 ] [ 1.56489e-10 3.87283e-10 4.500250000000001e-10 ] [ 2.74098e-10 -2.14768e-11 2.33093e-10 ] [ 4.21449e-10 1.24218e-10 3.87733e-10 ] [ 2.20243e-10 2.94328e-10 2.28142e-11 ] [ 4.00805e-10 4.02926e-10 1.38377e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -17.2502971 -6.4376136 -5.0885909 ] [ 18.7910301 -7.5666824 -1.0678157 ] [ 1.5911966 26.1755218 -0.271179 ] [ 2.907633 -0.9089363000000003 -12.1665072 ] [ -32.8912716 50.7680456 44.2055163 ] [ -20.7275307 -20.6659404 10.0687381 ] [ 11.5456068 0.3247789999999999 -5.0829233 ] [ 36.033633 -41.6891739 -30.5972383 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.763802271547404e-08 -1.031419400366412e-08 -8.15282137279563e-09 ] [ 3.010654910696909e-08 -1.212316163829884e-08 -1.710829349863187e-09 ] [ 2.549377991616449e-09 4.193780906520074e-08 -4.344766538519232e-10 ] [ 4.658541614466567e-09 -1.456276489656455e-09 -1.949289339263487e-08 ] [ -5.269762638590302e-08 8.133937574402831e-08 7.082504472625332e-08 ] [ -3.320916509445426e-08 -3.31104865557262e-08 1.613189678477821e-08 ] [ 1.84981012879095e-08 5.20353320726803e-10 -8.143740876579585e-09 ] [ 5.773224435508737e-08 -6.679341976304556e-08 -4.902217986530634e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -14.674763 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.351156219438087e-18 } }