{ "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" [ [ 2.9871519000000006 -1.8773168000000005 1.0829090000000001 ] [ -0.8659908000000002 -0.09614530000000003 -0.6977103000000001 ] [ 1.1049325000000003 -2.5061686000000005 1.8992345000000004 ] [ -0.5755553000000001 2.6334312000000004 1.1617974000000002 ] [ 0.8755811000000002 -0.8339856000000002 0.9878307000000002 ] [ -1.5729370000000005 1.4869212000000003 -1.5747808000000005 ] [ 0.5508013000000002 -1.3231355000000002 -2.1662944000000004 ] [ -2.5039837000000005 2.5163994000000005 -0.6929861000000002 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.785944976388706e-09 -3.007793111575651e-09 1.735011496548306e-09 ] [ -1.387470225018967e-09 -1.540417531289202e-10 -1.11785513996113e-09 ] [ 1.770297033647205e-09 -4.015324771784493e-09 3.042909138386673e-09 ] [ -9.221412532348604e-10 4.219221935886582e-09 1.861404647721952e-09 ] [ 1.402835579592018e-09 -1.336192241412471e-09 1.582679265887864e-09 ] [ -2.520122908154058e-09 2.382310403239241e-09 -2.523077001431828e-09 ] [ 8.824809728368244e-10 -2.119896781715907e-09 -3.47078627004505e-09 ] [ -4.011824176056866e-09 4.031716320491619e-09 -1.110286137106788e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.566411 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.698367265944057e-18 } }