{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.42981e-10 0.0 0.0 ] "source-value" [ 5.42981 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 3.70196e-12 5.47054e-10 0.0 ] "source-value" [ 0.0370196 5.47054 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -3.39139e-12 -1.43321e-12 5.52419e-10 ] "source-value" [ -0.0339139 -0.0143321 5.52419 ] } "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" [ [ -3.980846698911761e-09 -1.589799165533672e-09 -1.337642841116333e-10 ] [ 2.399677177093042e-09 8.303410113602286e-10 4.15960715211259e-09 ] [ 3.87768719261065e-10 7.283488509450316e-10 -1.33064773798992e-09 ] [ 1.585050954900269e-09 -9.44651346506784e-11 -3.000951952841916e-09 ] [ -2.009629521806551e-09 -1.025162964749253e-09 -1.997209769077434e-09 ] [ -1.734051778458048e-10 1.10484177158423e-09 2.930194706302201e-09 ] [ 4.748342011885786e-10 -1.512800800185293e-09 -1.897782372996814e-09 ] [ 1.316550506338825e-09 1.558696591447067e-09 1.270554098385264e-09 ] ] "source-value" [ [ -2.4846491 -0.9922746 -0.0834891 ] [ 1.4977607 0.5182581 2.5962226 ] [ 0.2420262 0.4545996 -0.830525 ] [ 0.989311 -0.0589605 -1.8730469 ] [ -1.2543121 -0.6398564 -1.2465603 ] [ -0.108231 0.689588 1.8288837 ] [ 0.2963682 -0.944216 -1.1845026 ] [ 0.8217262 0.9728619 0.7930175 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 8.65271e-12 2.02603e-12 -4.850630000000001e-12 ] [ 1.27669e-10 1.31148e-10 1.22292e-10 ] [ -1.37625e-12 2.6467e-10 2.79128e-10 ] [ 1.29807e-10 4.019929999999999e-10 4.311e-10 ] [ 2.70854e-10 -6.97941e-12 2.82717e-10 ] [ 4.06866e-10 1.27154e-10 4.01384e-10 ] [ 2.71531e-10 2.7055e-10 6.03487e-12 ] [ 4.06455e-10 4.016510000000001e-10 1.33765e-10 ] ] "source-value" [ [ 0.0865271 0.0202603 -0.0485063 ] [ 1.27669 1.31148 1.22292 ] [ -0.0137625 2.6467 2.79128 ] [ 1.29807 4.01993 4.311 ] [ 2.70854 -0.0697941 2.82717 ] [ 4.06866 1.27154 4.01384 ] [ 2.71531 2.7055 0.0603487 ] [ 4.06455 4.01651 1.33765 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.497302424741866e-18 "source-value" -21.828445 } }