{ "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" [ 5.37157 0 0 ] "si-unit" "m" "si-value" [ 5.37157e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00742946 5.44743 0 ] "si-unit" "m" "si-value" [ -7.42946e-13 5.447429999999999e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0324182 0.1292 5.41398 ] "si-unit" "m" "si-value" [ 3.24182e-12 1.292e-11 5.41398e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0294164 -0.0853048 -0.0527531 ] [ 1.50657 1.46533 1.29324 ] [ 0.0376731 2.77305 2.66982 ] [ 1.30492 4.09759 4.08062 ] [ 2.57907 0.017247 2.67471 ] [ 4.14556 1.36588 4.04305 ] [ 2.78643 2.5664 0.0569683 ] [ 4.11497 4.06206 1.21769 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.94164e-12 -8.530480000000001e-12 -5.27531e-12 ] [ 1.50657e-10 1.46533e-10 1.29324e-10 ] [ 3.76731e-12 2.77305e-10 2.66982e-10 ] [ 1.30492e-10 4.09759e-10 4.08062e-10 ] [ 2.57907e-10 1.7247e-12 2.67471e-10 ] [ 4.14556e-10 1.36588e-10 4.04305e-10 ] [ 2.78643e-10 2.5664e-10 5.69683e-12 ] [ 4.114969999999999e-10 4.06206e-10 1.21769e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.8344043 1.7136644 0.8978278 ] [ -3.7312645 -2.3898192 0.6554985 ] [ 0.5747937 -0.3915523 -0.4221144 ] [ 1.5737927 -0.830371 0.2283075 ] [ 3.5808717 -0.6828158 -0.2193536 ] [ -1.8961127 -0.4415952 -0.99532 ] [ 0.2954832 2.349985 -2.9166946 ] [ -2.2319683 0.6725042 2.7718488 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.93903968255499e-09 2.74559303757726e-09 1.438478710664298e-09 ] [ -5.978144747921001e-09 -3.828912450178959e-09 1.050224371669469e-09 ] [ 9.20921027923129e-10 -6.273359408804678e-10 -6.763018229830195e-10 ] [ 2.521493869925708e-09 -1.330401002790317e-09 3.65788938853296e-10 ] [ 5.737188919824351e-09 -1.093991511072849e-09 -3.514432096083149e-10 ] [ -3.037907438341965e-09 -7.075135052975001e-10 -1.594678434214656e-09 ] [ 4.734162748791706e-10 3.765091026230688e-09 -4.673059898133608e-09 ] [ -3.576007428626721e-09 1.077470506629807e-09 4.440991343752534e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.824672 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.739745192622838e-18 } }