{ "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" [ 5.46856 0 0 ] "si-unit" "m" "si-value" [ 5.46856e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.109414 5.47364 0 ] "si-unit" "m" "si-value" [ 1.09414e-11 5.47364e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0853482 0.188746 5.50226 ] "si-unit" "m" "si-value" [ 8.53482e-12 1.88746e-11 5.50226e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.111998 0.00598912 -0.142628 ] [ 1.42992 1.39997 1.14788 ] [ 0.0344059 2.83471 2.60329 ] [ 1.5648 4.17845 4.01026 ] [ 2.81953 0.00757671 2.62729 ] [ 4.17997 1.38562 3.91338 ] [ 2.81257 2.67111 -0.166315 ] [ 4.15871 3.96748 1.06238 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.11998e-11 5.98912e-13 -1.42628e-11 ] [ 1.42992e-10 1.39997e-10 1.14788e-10 ] [ 3.44059e-12 2.83471e-10 2.60329e-10 ] [ 1.5648e-10 4.17845e-10 4.01026e-10 ] [ 2.81953e-10 7.576710000000001e-13 2.62729e-10 ] [ 4.17997e-10 1.38562e-10 3.91338e-10 ] [ 2.81257e-10 2.67111e-10 -1.66315e-11 ] [ 4.15871e-10 3.96748e-10 1.06238e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0343741 -0.8676765 -0.4175673 ] [ -0.0299564 -0.0844738 1.6611514 ] [ 0.896102 -0.4773359 -0.221217 ] [ -0.78951 0.19695 -0.6334091 ] [ -0.2883923 -0.2546614 -1.3828909 ] [ 0.4176637 0.5385954 0.6168042 ] [ -0.0723417 -1.062478 -0.9939796 ] [ 0.9008088 2.0110803 1.3711083 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.657250013834779e-09 -1.390171014170901e-09 -6.690165711824681e-10 ] [ -4.79954441187576e-11 -1.353419485451892e-10 2.661457958616387e-09 ] [ 1.435713686080668e-09 -7.647764255493605e-10 -3.54428708443578e-10 ] [ -1.26493447430934e-09 3.155486880663e-10 -1.014833259782969e-09 ] [ -4.620554044855181e-10 -4.080125446617275e-10 -2.21563548735123e-09 ] [ 6.691710210099858e-10 8.629249650598834e-10 9.882292769930627e-10 ] [ -1.159041814038378e-10 -1.702277425739052e-09 -1.592530889792666e-09 ] [ 1.443254811061579e-09 3.22210586575771e-09 2.196757680943462e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -26.18528107419016 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.19534454917899e-18 } }