{ "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" [ [ -6.131328213765041e-09 -2.125608523903671e-09 -1.851356741926541e-10 ] [ 3.508432265073577e-09 1.331032741031898e-09 6.117154718506797e-09 ] [ 9.323741874969176e-10 1.23013038115417e-09 -1.7767568349795e-09 ] [ 2.138705837125724e-09 -4.954280988193555e-10 -4.489086442861682e-09 ] [ -3.309257037588177e-09 -1.548924435583822e-09 -2.846568136273572e-09 ] [ -3.914287315336205e-10 1.654997660287521e-09 4.460135912412136e-09 ] [ 1.094667309171502e-09 -2.434841909784023e-09 -2.815697877796984e-09 ] [ 2.157834384019117e-09 2.388642185617283e-09 1.53595433518546e-09 ] ] "source-value" [ [ -3.8268741 -1.3267005 -0.1155526 ] [ 2.1897912 0.8307653 3.8180277 ] [ 0.5819422 0.767787 -1.1089644 ] [ 1.3348752 -0.3092219 -2.8018674 ] [ -2.0654758 -0.9667626 -1.7766881 ] [ -0.2443106 1.0329683 2.7837979 ] [ 0.6832376 -1.5197088 -1.7574204 ] [ 1.3468143 1.4908732 0.9586673 ] ] } "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" -5.732676709807193e-18 "source-value" -35.780554 } }