{ "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" [ 5.36644 0 0 ] "si-unit" "m" "si-value" [ 5.366440000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.227231 5.37948 0 ] "si-unit" "m" "si-value" [ -2.27231e-11 5.379480000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0350261 -0.0899265 5.39939 ] "si-unit" "m" "si-value" [ -3.50261e-12 -8.992650000000001e-12 5.399390000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00104229 0.0077963 0.00224549 ] [ 1.32493 1.37357 1.36608 ] [ -0.0958533 2.66355 2.80902 ] [ 1.19786 4.07015 4.22336 ] [ 2.70129 0.113781 2.60003 ] [ 3.9906 1.45175 3.98519 ] [ 2.48193 2.86985 0.00162227 ] [ 4.00824 4.16333 1.43322 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.04229e-13 7.7963e-13 2.24549e-13 ] [ 1.32493e-10 1.37357e-10 1.36608e-10 ] [ -9.58533e-12 2.66355e-10 2.80902e-10 ] [ 1.19786e-10 4.07015e-10 4.22336e-10 ] [ 2.70129e-10 1.13781e-11 2.60003e-10 ] [ 3.9906e-10 1.45175e-10 3.98519e-10 ] [ 2.48193e-10 2.86985e-10 1.62227e-13 ] [ 4.00824e-10 4.16333e-10 1.43322e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0009234 2.1669628 -0.6684498 ] [ -0.9331314 1.0527895 -0.2516677 ] [ 1.5140596 1.8601964 -1.8564301 ] [ -0.3051575 0.9295246 -3.0333937 ] [ 0.1276745 -1.4218368 1.6995849 ] [ -1.4128201 -1.4733483 2.6133098 ] [ 2.7841242 -1.5242207 1.1617254 ] [ -1.7756727 -1.5900675 0.3353211 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.4794499038356e-12 3.471857164907215e-09 -1.070974650561973e-09 ] [ -1.495041325531708e-09 1.686754737420543e-09 -4.032161084725218e-10 ] [ 2.425790913603386e-09 2.980363206730917e-09 -2.974328928874283e-09 ] [ -4.88916216189855e-10 1.489262594848196e-09 -4.860032507862806e-09 ] [ 2.04557100657633e-10 -2.278033698321331e-09 2.723035214279227e-09 ] [ -2.263587352265543e-09 -2.360564220003622e-09 4.186983898963213e-09 ] [ 4.460658739393942e-09 -2.442070790599124e-09 1.861289291004303e-09 ] [ -2.844941309571692e-09 -2.547568994982795e-09 5.372436313071773e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.714629 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.722114407577879e-18 } }