{ "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" [ 5.5417 0 0 ] "si-unit" "m" "si-value" [ 5.5417e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0877832 5.55439 0 ] "si-unit" "m" "si-value" [ -8.77832e-12 5.55439e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0308884 0.040745 5.63916 ] "si-unit" "m" "si-value" [ 3.08884e-12 4.074500000000001e-12 5.63916e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.159411 -0.0874723 -0.00774134 ] [ 1.28203 1.40365 1.4018 ] [ -0.0744566 2.77196 2.86869 ] [ 1.41795 4.01233 4.00515 ] [ 2.72183 0.105785 2.67146 ] [ 4.038 1.47487 4.29534 ] [ 2.69485 2.74872 0.0100738 ] [ 4.0446 4.15007 1.27967 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.59411e-11 -8.747230000000001e-12 -7.74134e-13 ] [ 1.28203e-10 1.40365e-10 1.4018e-10 ] [ -7.44566e-12 2.77196e-10 2.86869e-10 ] [ 1.41795e-10 4.01233e-10 4.00515e-10 ] [ 2.72183e-10 1.05785e-11 2.67146e-10 ] [ 4.038e-10 1.47487e-10 4.29534e-10 ] [ 2.69485e-10 2.74872e-10 1.00738e-12 ] [ 4.0446e-10 4.150070000000001e-10 1.27967e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.6945093 1.0103514 -1.3205038 ] [ -0.6026794 -0.0515201 -0.4660766 ] [ -0.8602044 -0.4132174 -1.3132864 ] [ -0.0910849 1.7156574 1.6335283 ] [ 0.6035115 -0.9563394 0.7850894 ] [ 0.498819 -1.0467252 -0.870004 ] [ -0.8074505 0.1355249 -0.3391113 ] [ -0.4354207 -0.3937316 1.8903643 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.714903184188174e-09 1.618761391872549e-09 -2.115680316037559e-09 ] [ -9.655988445177715e-10 -8.254429972127809e-11 -7.467370320219533e-10 ] [ -1.378199378789292e-09 -6.620472575877619e-10 -2.104116766494597e-09 ] [ -1.459340972879059e-10 2.748786175582514e-09 2.617200851675169e-09 ] [ 9.669320156839393e-10 -1.5322246282299e-09 1.2578518819179e-09 ] [ 7.991961398108352e-10 -1.677038643842204e-09 -1.393900068802483e-09 ] [ -1.29367831355327e-09 2.171348263162579e-10 -5.433161967090951e-10 ] [ -6.976208657523705e-10 -6.308275643901773e-10 3.028697486254958e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.028105240654234 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.728203211309818e-18 } }