{ "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" [ 5.40836 0 0 ] "si-unit" "m" "si-value" [ 5.40836e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0676972 5.56169 0 ] "si-unit" "m" "si-value" [ 6.76972e-12 5.561689999999999e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0290382 0.0456166 5.46301 ] "si-unit" "m" "si-value" [ 2.90382e-12 4.56166e-12 5.46301e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.160852 -0.0174641 0.0414383 ] [ 1.3693 1.3835 1.35672 ] [ 0.168786 2.76991 2.61562 ] [ 1.32577 4.00891 4.07743 ] [ 2.71647 0.0672876 2.67609 ] [ 4.01486 1.47906 4.19059 ] [ 2.74225 2.69331 -0.0428987 ] [ 4.04746 4.06755 1.1226 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.60852e-11 -1.74641e-12 4.14383e-12 ] [ 1.3693e-10 1.3835e-10 1.35672e-10 ] [ 1.68786e-11 2.76991e-10 2.61562e-10 ] [ 1.32577e-10 4.008910000000001e-10 4.07743e-10 ] [ 2.71647e-10 6.728760000000001e-12 2.67609e-10 ] [ 4.01486e-10 1.47906e-10 4.19059e-10 ] [ 2.74225e-10 2.69331e-10 -4.28987e-12 ] [ 4.04746e-10 4.06755e-10 1.1226e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.9001448 -0.6842531 -1.5650063 ] [ 1.858053 -0.2690174 -0.4905144 ] [ -4.1105903 -0.1197073 0.5215547 ] [ 2.5147078 2.6670693 0.0468891 ] [ 0.0615011 -1.8157292 0.7985643 ] [ 3.3310293 -2.571279 -3.0082562 ] [ -2.8262016 0.6712404 0.6018528 ] [ 2.0716455 2.1216763 3.0949159 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.646544233776603e-09 -1.096294328562065e-09 -2.507416525922794e-09 ] [ 2.976929101333601e-09 -4.310133924194315e-10 -7.858907103205295e-10 ] [ -6.58589173060705e-09 -1.917922389792282e-10 8.356227536928798e-10 ] [ 4.029006078497545e-09 4.273116113718736e-09 7.51246204092894e-11 ] [ 9.85356253852974e-11 -2.909118897911513e-09 1.279441062206566e-09 ] [ 5.336897311629376e-09 -4.119643133294886e-09 -4.81975779272563e-09 ] [ -4.528074166493415e-09 1.075445684676813e-09 9.64274493267475e-10 ] [ 3.319142014031246e-09 3.399300192771574e-09 4.958601939175081e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.985426 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.605283206773608e-18 } }