{ "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" [ 5.46497 0 0 ] "si-unit" "m" "si-value" [ 5.46497e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00264453 5.45437 0 ] "si-unit" "m" "si-value" [ 2.64453e-13 5.45437e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.00434361 0.134648 5.52148 ] "si-unit" "m" "si-value" [ -4.343610000000001e-13 1.34648e-11 5.521480000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.000601708 -0.00129581 -0.00103934 ] [ 1.36071 1.38338 1.29931 ] [ 0.0379757 2.81246 2.65752 ] [ 1.43056 4.2109 3.80234 ] [ 2.71672 0.059655 2.71923 ] [ 4.18219 1.40754 3.91392 ] [ 2.71688 2.7266 0.0375018 ] [ 4.08381 4.07468 1.29537 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.017079999999999e-14 -1.29581e-13 -1.03934e-13 ] [ 1.36071e-10 1.38338e-10 1.29931e-10 ] [ 3.79757e-12 2.812460000000001e-10 2.65752e-10 ] [ 1.43056e-10 4.2109e-10 3.80234e-10 ] [ 2.71672e-10 5.9655e-12 2.71923e-10 ] [ 4.18219e-10 1.40754e-10 3.91392e-10 ] [ 2.71688e-10 2.7266e-10 3.75018e-12 ] [ 4.08381e-10 4.07468e-10 1.29537e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.9737567 0.9038725 -0.1141567 ] [ -0.0969386 -0.3051143 0.135781 ] [ -0.2114478 -0.3607924 -0.3628701 ] [ -1.6135443 -1.5919216 1.7315443 ] [ 1.9583925 1.5301237 -2.1519762 ] [ 0.6992115 -1.0142629 0.6508131 ] [ 0.0933356 0.0427877 -0.0373491 ] [ 0.1447478 0.7953072 0.1482137 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.560130231940948e-09 1.448163399615165e-09 -1.828991973545478e-10 ] [ -1.553127598526724e-10 -4.888470021592662e-10 2.17545145541154e-10 ] [ -3.387767244707052e-10 -5.780531530047815e-10 -5.813819953972434e-10 ] [ -2.585182975383886e-09 -2.550539590679894e-09 2.774239818195886e-09 ] [ 3.137690703700845e-09 2.451528439269626e-09 -3.44784598456411e-09 ] [ 1.120260327524091e-09 -1.625028319113079e-09 1.042717541921105e-09 ] [ 1.495401174403704e-10 6.855345316260178e-11 -5.98398553209294e-11 ] [ 2.319115429829052e-10 1.274222612691965e-09 2.374645269786858e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -30.653087 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.911165975136916e-18 } }