{ "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" [ 5.44038 0 0 ] "si-unit" "m" "si-value" [ 5.44038e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0177809 5.34742 0 ] "si-unit" "m" "si-value" [ 1.77809e-12 5.34742e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.258508 -0.216411 5.45927 ] "si-unit" "m" "si-value" [ 2.58508e-11 -2.16411e-11 5.459270000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0111666 -0.0485116 -0.0844937 ] [ 1.40892 1.32935 1.34318 ] [ 0.251238 2.67562 2.78628 ] [ 1.4893 4.10816 4.17197 ] [ 2.79244 -0.0558727 2.81547 ] [ 4.18247 1.3542 3.88471 ] [ 2.61313 2.71504 -0.144964 ] [ 4.08224 4.0407 1.29994 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.11666e-12 -4.851160000000001e-12 -8.44937e-12 ] [ 1.40892e-10 1.32935e-10 1.34318e-10 ] [ 2.51238e-11 2.67562e-10 2.78628e-10 ] [ 1.4893e-10 4.10816e-10 4.17197e-10 ] [ 2.79244e-10 -5.58727e-12 2.81547e-10 ] [ 4.182470000000001e-10 1.3542e-10 3.88471e-10 ] [ 2.61313e-10 2.71504e-10 -1.44964e-11 ] [ 4.08224e-10 4.0407e-10 1.29994e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.6673691 4.9272626 3.0499111 ] [ 0.4273003 -0.3523035 0.4435491 ] [ -1.3587541 0.6653918 -1.9210474 ] [ 2.5789695 -4.2846951 -2.7076601 ] [ -0.078633 0.4925082 -2.385805 ] [ 1.678629 -1.4405622 1.5043148 ] [ -0.1039618 1.5707195 1.4749201 ] [ 0.5238192 -1.5783214 0.5418174 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.875773031864338e-09 7.894344942262221e-09 4.886496259938411e-09 ] [ 6.846105507208263e-10 -5.644524311260128e-10 7.106439981968813e-10 ] [ -2.176964052436145e-09 1.06607518563203e-09 -3.077857231728626e-09 ] [ 4.131964638656266e-09 -6.864838316476319e-09 -4.338149709292991e-09 ] [ -1.259839542233664e-10 7.890851235922906e-10 -3.822480992787744e-09 ] [ 2.689460138796883e-09 -2.308035077648214e-09 2.410178002883428e-09 ] [ -1.665651654162854e-10 2.516570060734665e-09 2.363082501767999e-09 ] [ 8.392508757661594e-10 -2.528749647188325e-09 8.680871710226419e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -40.297213 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.456325255199783e-18 } }