{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.45404e-10 0.0 0.0 ] "source-value" [ 5.45404 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 2.69758e-13 5.32364e-10 0.0 ] "source-value" [ 0.00269758 5.32364 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -2.64471e-12 4.33477e-12 5.272210000000001e-10 ] "source-value" [ -0.0264471 0.0433477 5.27221 ] } "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" [ [ -2.726439977381568e-09 4.755584651300112e-09 5.84703719308198e-09 ] [ -3.438279679990552e-09 1.567203828868191e-09 -1.680850382240749e-09 ] [ -3.772313638437255e-10 -1.227872914295462e-10 -1.310612359129154e-09 ] [ 5.580945456852246e-09 -3.401489699335433e-09 -5.315648880879416e-09 ] [ -3.406579974677376e-10 3.719983986519334e-09 9.944606143825248e-10 ] [ 1.152790591967898e-09 -4.402838071010777e-09 -4.65872362173069e-09 ] [ -2.252841374802951e-10 2.423645579122548e-09 1.013799462979164e-08 ] [ 3.741569471260723e-10 -4.539303144252092e-09 -4.013657193276139e-09 ] ] "source-value" [ [ -1.70171 2.9682025 3.6494336 ] [ -2.1460054 0.9781717 -1.0491043 ] [ -0.2354493 -0.0766378 -0.8180199 ] [ 3.4833522 -2.1230429 -3.3177671 ] [ -0.212622 2.3218314 0.6206935 ] [ 0.7195153 -2.7480354 -2.9077466 ] [ -0.1406113 1.5127206 6.3276386 ] [ 0.2335304 -2.8332102 -2.5051278 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.65045e-12 3.66931e-12 2.59636e-12 ] [ 1.48655e-10 1.36127e-10 1.37402e-10 ] [ -1.76096e-12 2.76119e-10 2.70854e-10 ] [ 1.17184e-10 4.14313e-10 4.05378e-10 ] [ 2.72197e-10 2.31604e-12 2.74475e-10 ] [ 4.08411e-10 1.50063e-10 4.06205e-10 ] [ 2.69936e-10 2.73466e-10 -1.81062e-11 ] [ 4.07246e-10 4.14715e-10 1.4277e-10 ] ] "source-value" [ [ 0.0265045 0.0366931 0.0259636 ] [ 1.48655 1.36127 1.37402 ] [ -0.0176096 2.76119 2.70854 ] [ 1.17184 4.14313 4.05378 ] [ 2.72197 0.0231604 2.74475 ] [ 4.08411 1.50063 4.06205 ] [ 2.69936 2.73466 -0.181062 ] [ 4.07246 4.14715 1.4277 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.589768963938315e-18 "source-value" -34.888594 } }