{ "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" [ 5.41394 0 0 ] "si-unit" "m" "si-value" [ 5.413940000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0321649 5.43167 0 ] "si-unit" "m" "si-value" [ 3.216490000000001e-12 5.431670000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.034689 -0.0250046 5.52467 ] "si-unit" "m" "si-value" [ -3.4689e-12 -2.50046e-12 5.52467e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0104706 0.0216981 0.0176006 ] [ 1.39448 1.38403 1.49781 ] [ 0.0179868 2.6904 2.7801 ] [ 1.33759 4.02716 4.17727 ] [ 2.6683 -0.0231463 2.83015 ] [ 4.02805 1.42643 4.22871 ] [ 2.71964 2.8128 -0.0574889 ] [ 4.09713 4.0529 1.34951 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.04706e-12 2.16981e-12 1.76006e-12 ] [ 1.39448e-10 1.38403e-10 1.49781e-10 ] [ 1.79868e-12 2.6904e-10 2.7801e-10 ] [ 1.33759e-10 4.02716e-10 4.17727e-10 ] [ 2.6683e-10 -2.31463e-12 2.83015e-10 ] [ 4.02805e-10 1.42643e-10 4.228710000000001e-10 ] [ 2.71964e-10 2.8128e-10 -5.74889e-12 ] [ 4.09713e-10 4.052900000000001e-10 1.34951e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.8161792 0.5147378 0.7333673 ] [ 0.1416797 0.043641 -2.4355554 ] [ -0.7183016 0.3633435 0.3556066 ] [ -0.4999063 1.169651 -0.5850397 ] [ 1.2516966 -0.1664065 0.0271779 ] [ 0.1115919 -1.1066087 -1.370467 ] [ -0.7015992 -1.660158 2.2275448 ] [ -0.4013403 0.8417998 1.0473655 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.307663243396813e-09 8.247008757965651e-10 1.174983952199668e-09 ] [ 2.269959048521298e-10 6.992059048439399e-11 -3.902189952692523e-09 ] [ -1.150846039684814e-09 5.821404658157789e-10 5.697445854161843e-10 ] [ -8.009381930493941e-10 1.873987502134734e-09 -9.373369373023696e-10 ] [ 2.005439045377244e-09 -2.66612606045721e-10 4.35437963411886e-11 ] [ 1.787899347236646e-10 -1.772982602121116e-09 -2.195730205068078e-09 ] [ -1.124085844673093e-09 -2.659866356348171e-09 3.568920229748203e-09 ] [ -6.430180509425501e-10 1.348711970065873e-09 1.678064531357727e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.700047 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.879995777010179e-18 } }