{ "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" [ [ 0.251501 2.445252 -0.6942035 ] [ -1.1579297 1.000412 -0.4017037 ] [ 2.0971239 2.3371568 -2.2490284 ] [ -0.7097412 1.1032005 -3.2819726 ] [ 0.3183303 -1.3647176 1.7383966 ] [ -1.9629942 -2.0275171 2.9106439 ] [ 3.0265973 -1.7155374 1.4895812 ] [ -1.8628874 -1.7782492 0.4882864 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.029490223078208e-10 3.917725586364441e-09 -1.112236617777533e-09 ] [ -1.855207893869958e-09 1.60283671756777e-09 -6.436002766288569e-10 ] [ 3.359962883500918e-09 3.744537984103742e-09 -3.60334072199523e-09 ] [ -1.137130757458537e-09 1.76752204915487e-09 -5.25829976982619e-09 ] [ 5.100213643522503e-10 -2.186518632714286e-09 2.785218390198209e-09 ] [ -3.145063414006e-09 -3.248440495892216e-09 4.663365608054134e-09 ] [ 4.849143434636404e-09 -2.748593914388018e-09 2.386572173423209e-09 ] [ -2.984674639462898e-09 -2.849069294196303e-09 7.823210543345972e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.643644 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.71074130969182e-18 } }