{ "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" [ 5.23298 0 0 ] "si-unit" "m" "si-value" [ 5.23298e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.924429 5.53043 0 ] "si-unit" "m" "si-value" [ -9.24429e-11 5.53043e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.629107 -0.473789 5.46851 ] "si-unit" "m" "si-value" [ -6.29107e-11 -4.73789e-11 5.46851e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.204863 0.0604192 -0.0594365 ] [ 1.57212 1.62558 1.26329 ] [ -0.456749 2.61396 2.82457 ] [ 0.563094 3.85296 4.15247 ] [ 2.57153 0.0726254 2.31215 ] [ 3.48703 1.34311 4.10214 ] [ 2.49706 2.93083 0.328276 ] [ 3.43659 4.115 1.72734 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.04863e-11 6.04192e-12 -5.94365e-12 ] [ 1.57212e-10 1.62558e-10 1.26329e-10 ] [ -4.56749e-11 2.61396e-10 2.82457e-10 ] [ 5.63094e-11 3.85296e-10 4.15247e-10 ] [ 2.57153e-10 7.262540000000001e-12 2.31215e-10 ] [ 3.48703e-10 1.34311e-10 4.102140000000001e-10 ] [ 2.49706e-10 2.93083e-10 3.28276e-11 ] [ 3.43659e-10 4.115e-10 1.72734e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.9499236 0.5333737 0.2508709 ] [ -13.6694448 -6.2935501 6.8122794 ] [ 2.7718576 -3.0595231 -5.5746413 ] [ 3.3277511 6.117002 0.7651479 ] [ 0.3979102 -5.7717344 7.1538297 ] [ -0.9013098 -2.0455327 2.0986743 ] [ 4.8357799 6.0921901 -12.001776 ] [ 2.2875322 4.4277745 0.495615 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.521945396005162e-09 8.545588793301256e-10 4.019394941305506e-10 ] [ -2.19008650583128e-08 -1.008337891512836e-08 1.091447487895954e-08 ] [ 4.441005479495318e-09 -4.901896422003245e-09 -8.931560033791384e-09 ] [ 5.331645056187797e-09 9.800517674531267e-09 1.225902086934168e-09 ] [ 6.375224248702668e-10 -9.247337993334008e-09 1.146169878895523e-08 ] [ -1.444057501555213e-09 -3.277304696022931e-09 3.362446925836306e-09 ] [ 7.747773562946856e-09 9.760764628106121e-09 -1.922896507370198e-08 ] [ 3.665030640362614e-09 7.094076844521032e-09 7.940627724599099e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -28.990072 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.644721597637765e-18 } }