{ "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" [ [ -3.4834305 -1.411926 0.5291561 ] [ 2.2292733 -0.3138764 3.9061115 ] [ 0.6302028 0.7272867 -1.0263719 ] [ 1.349005 0.1961653 -2.8452391 ] [ -2.6383952 -0.5242979 -2.002349 ] [ -0.7612781 1.3820232 3.0368769 ] [ 1.1371163 -1.8324119 -2.1579367 ] [ 1.5375064 1.7770371 0.5597524 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.581070953262936e-09 -2.262154846137084e-09 8.478015391585674e-10 ] [ 3.571689592060072e-09 -5.028854340440375e-10 6.25828057509869e-09 ] [ 1.009696200841375e-09 1.165241756958968e-09 -1.644429075974184e-09 ] [ 2.16134429014917e-09 3.142914600616001e-10 -4.558575604163188e-09 ] [ -4.227175140697757e-09 -8.400178446352685e-10 -3.208116780913266e-09 ] [ -1.219701983795915e-09 2.214245278685909e-09 4.865613209514355e-09 ] [ 1.821861166000534e-09 -2.935847530043545e-09 -3.457395758391067e-09 ] [ 2.463356828705458e-09 2.847127319371121e-09 8.968222161054216e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.773639 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.731568851895113e-18 } }