{ "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" [ [ 1.4497606000000003 -0.8873040000000002 -0.6397342000000001 ] [ -0.28946220000000006 -1.0770665000000001 -0.6145004000000001 ] [ -0.4594894000000001 -1.2457089000000001 1.3893689000000002 ] [ 0.4659103000000001 0.8893750000000002 0.7749804000000002 ] [ 0.10045290000000003 -0.19842560000000006 0.6972846000000001 ] [ -0.9662226000000003 0.8509421000000003 -0.5453783000000001 ] [ -0.3886593000000001 0.07459970000000002 -0.5120275000000001 ] [ 0.08770960000000001 1.5935882000000003 -0.5499936000000001 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.322772539076981e-09 -1.421617724342324e-09 -1.024967178766192e-09 ] [ -4.637695694453338e-10 -1.725650765346883e-09 -9.845381743522485e-10 ] [ -7.361831741854196e-10 -1.995845675902485e-09 2.226014369246613e-09 ] [ 7.464705900499144e-10 1.424935832124001e-09 1.241655478458233e-09 ] [ 1.609432878715604e-10 -3.179128572882126e-10 1.11717308416388e-09 ] [ -1.54805926020859e-09 1.363359538274456e-09 -8.737923617516487e-10 ] [ -6.227008439164936e-10 1.195218952586938e-10 -8.203584897066721e-10 ] [ 1.405262705397197e-10 2.553209757222755e-09 -8.811868875096271e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 145.586 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.332544855157888e-17 } }