{ "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" [ [ 2.6756897000000004 -1.6956634000000004 0.3231972000000001 ] [ -0.7250889000000001 -0.20187950000000005 -0.6423519000000001 ] [ 0.5277783000000001 -1.8035581000000005 1.4337902000000002 ] [ -0.7686778000000002 2.5459233000000006 1.2879925000000003 ] [ 0.7566054000000002 -0.7590939000000002 0.8506368000000002 ] [ -1.1694709000000003 1.1891202000000003 -1.0434018000000003 ] [ 0.5164728000000001 -1.1172085000000003 -1.9120944000000004 ] [ -1.8133086000000005 1.8423598000000005 -0.29776860000000005 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.28692751717447e-09 -2.716752278608996e-09 5.178190020142249e-10 ] [ -1.161720493152763e-09 -3.23446617783603e-10 -1.029161204985505e-09 ] [ 8.455940601922423e-10 -2.889618645881436e-09 2.297185156498187e-09 ] [ -1.231557610234525e-09 4.079018823216172e-09 2.063591488267245e-09 ] [ 1.212215493038224e-09 -1.216202509591933e-09 1.362870404980531e-09 ] [ -1.873698950122951e-09 1.905180599457407e-09 -1.671713983833541e-09 ] [ 8.274806522565552e-10 -1.789965354006189e-09 -3.06351296968225e-09 ] [ -2.905240669151253e-09 2.951785822980914e-09 -4.770778932588924e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -34.41109229230348 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.513264802114613e-18 } }