{ "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" [ 5.39198 0 0 ] "si-unit" "m" "si-value" [ 5.39198e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0815956 5.53401 0 ] "si-unit" "m" "si-value" [ 8.15956e-12 5.534010000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.109849 -0.0410552 5.55668 ] "si-unit" "m" "si-value" [ -1.09849e-11 -4.10552e-12 5.55668e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0600222 -0.0188866 -0.0475744 ] [ 1.35953 1.30974 1.45574 ] [ -0.0201429 2.70129 2.75612 ] [ 1.43727 3.87805 4.08993 ] [ 2.67575 -0.0837777 2.76281 ] [ 3.98871 1.3119 4.2787 ] [ 2.73779 2.77507 0.256836 ] [ 4.26747 4.05038 1.42682 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.00222e-12 -1.88866e-12 -4.75744e-12 ] [ 1.35953e-10 1.30974e-10 1.45574e-10 ] [ -2.01429e-12 2.70129e-10 2.75612e-10 ] [ 1.43727e-10 3.87805e-10 4.08993e-10 ] [ 2.67575e-10 -8.37777e-12 2.76281e-10 ] [ 3.98871e-10 1.3119e-10 4.2787e-10 ] [ 2.73779e-10 2.77507e-10 2.56836e-11 ] [ 4.26747e-10 4.05038e-10 1.42682e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.3178804000000004 -1.4009410000000002 1.0532725000000003 ] [ -0.4683362000000001 -0.3285619000000001 -0.6273336000000002 ] [ 0.5540765000000001 -1.7626828000000005 1.5278592000000004 ] [ -0.15806030000000001 2.1195805000000005 1.1015145000000002 ] [ 0.5132474000000001 -0.5743741000000001 0.8819805000000002 ] [ -1.0124516000000001 1.0471841000000002 -1.3674020000000002 ] [ 0.15354610000000002 -0.8906304000000003 -2.0691828000000005 ] [ -1.8999023000000004 1.7904256000000005 -0.5007083000000001 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.713653786690553e-09 -2.244554917320173e-09 1.687528574831569e-09 ] [ -7.503573103143132e-10 -5.264141946656277e-10 -1.005099227362299e-09 ] [ 8.877284144346914e-10 -2.824129172046283e-09 2.447900290114192e-09 ] [ -2.532405173366343e-10 3.395942323003575e-09 1.764820779372202e-09 ] [ 8.223129849663862e-10 -9.202487546130415e-10 1.413088537101495e-09 ] [ -1.622126283211554e-09 1.67777388269349e-09 -2.190819515635162e-09 ] [ 2.460079716350189e-10 -1.426947204653753e-09 -3.315196306321483e-09 ] [ -3.043979046864149e-09 2.868578037601814e-09 -8.022231321005129e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.837693 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.741831386800782e-18 } }