{ "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" [ 5.46856 0 0 ] "si-unit" "m" "si-value" [ 5.46856e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.109414 5.47364 0 ] "si-unit" "m" "si-value" [ 1.09414e-11 5.47364e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0853482 0.188746 5.50226 ] "si-unit" "m" "si-value" [ 8.53482e-12 1.88746e-11 5.50226e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.111998 0.00598912 -0.142628 ] [ 1.42992 1.39997 1.14788 ] [ 0.0344059 2.83471 2.60329 ] [ 1.5648 4.17845 4.01026 ] [ 2.81953 0.00757671 2.62729 ] [ 4.17997 1.38562 3.91338 ] [ 2.81257 2.67111 -0.166315 ] [ 4.15871 3.96748 1.06238 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.11998e-11 5.98912e-13 -1.42628e-11 ] [ 1.42992e-10 1.39997e-10 1.14788e-10 ] [ 3.44059e-12 2.83471e-10 2.60329e-10 ] [ 1.5648e-10 4.17845e-10 4.01026e-10 ] [ 2.81953e-10 7.576710000000001e-13 2.62729e-10 ] [ 4.17997e-10 1.38562e-10 3.91338e-10 ] [ 2.81257e-10 2.67111e-10 -1.66315e-11 ] [ 4.15871e-10 3.96748e-10 1.06238e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.0600979 -0.0124223 0.0993174 ] [ -0.0827797 -0.0385926 0.2837325 ] [ 0.1683735 0.084658 0.0815777 ] [ -0.2135319 -0.0421238 -0.1945771 ] [ 0.0280546 -0.0207372 -0.1885388 ] [ 0.026188 -0.0750646 -0.0391919 ] [ 0.0571873 -0.1400276 -0.0876782 ] [ 0.0766062 0.24431 0.0453584 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.628745033917634e-11 -1.990271863656384e-11 1.591240163186419e-10 ] [ -1.326277000168378e-10 -6.183216145588608e-11 4.54589578061136e-10 ] [ 2.697640852622688e-10 1.356370683636864e-10 1.307018837186362e-10 ] [ -3.421158179750035e-10 -6.748976753925505e-11 -3.117468805630637e-10 ] [ 4.494842422589568e-11 -3.322465702085376e-11 -3.02072457473687e-10 ] [ 4.19578013455104e-11 -1.202667471697037e-10 -6.279234590473152e-11 ] [ 9.162415506667584e-11 -2.243489469867341e-10 -1.404759621938265e-10 ] [ 1.22736662648329e-10 3.91427770227648e-10 7.267216803689473e-11 ] ] } "unrelaxed-potential-energy" { "source-value" 29.371706 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.705866066621109e-18 } }