{ "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" [ [ -2.6821659 -1.0204488 -0.2584721 ] [ 1.5612839 0.7319142 2.864098 ] [ 0.4146182 0.5725996 -0.9320741 ] [ 0.9442719 -0.1940593 -1.8607191 ] [ -1.4126638 -0.8052405 -1.3404557 ] [ -0.0907107 0.6622172 1.680156 ] [ 0.3557772 -1.0288499 -1.0623735 ] [ 0.9095892 1.0818677 0.9098406 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.297303498086991e-09 -1.634939210083415e-09 -4.141179557490797e-10 ] [ 2.501452563011445e-09 1.172655819671535e-09 4.588790855280039e-09 ] [ 6.642915865981786e-10 9.174056921994317e-10 -1.493347331873201e-09 ] [ 1.512890361858396e-09 -3.109172735088134e-10 -2.981200639896018e-09 ] [ -2.263336913410487e-09 -1.290137503221302e-09 -2.147646783758099e-09 ] [ -1.453345627964026e-10 1.060988915731638e-09 2.691906662496845e-09 ] [ 5.700179120536857e-10 -1.648399256092418e-09 -1.702109984257469e-09 ] [ 1.457322550772175e-09 1.733343135738668e-09 1.457725337974644e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.195959038775914 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.755096354416121e-18 } }