{ "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" [ 5.42981 0 0 ] "si-unit" "m" "si-value" [ 5.42981e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0370196 5.47054 0 ] "si-unit" "m" "si-value" [ 3.70196e-12 5.47054e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0339139 -0.0143321 5.52419 ] "si-unit" "m" "si-value" [ -3.39139e-12 -1.43321e-12 5.52419e-10 ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.3224781 -1.15797 -0.1391693 ] [ 1.8309667 0.8961486 3.2241627 ] [ 0.5494026 0.711852 -0.8979092 ] [ 1.1322718 -0.3478414 -2.5963366 ] [ -1.4715101 -0.8237177 -1.4267484 ] [ -0.135096 0.721665 2.2883628 ] [ 0.4466348 -1.1135505 -1.2977127 ] [ 0.9698084 1.1134139 0.8453507 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.323196734940005e-09 -1.855272461587776e-09 -2.229737987931014e-10 ] [ 2.933532040203327e-09 1.435788335682651e-09 5.165678099595404e-09 ] [ 8.80240001126734e-10 1.140512631869722e-09 -1.438609127841231e-09 ] [ 1.814099406351133e-09 -5.573033588263412e-10 -4.159789800247361e-09 ] [ -2.35761907949107e-09 -1.319741241079148e-09 -2.285902930243807e-09 ] [ -2.164476527635968e-10 1.156234791049632e-09 3.666361378068426e-09 ] [ 7.155878345956839e-10 -1.784104577180151e-09 -2.079164948455244e-09 ] [ 1.553804345135455e-09 1.783885719853749e-09 1.354401127916915e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.913153 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.753921411581339e-18 } }