{ "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" [ [ -1.0607615 -0.9286237 -0.4819773 ] [ -0.1309153 -0.1857134 1.5539801 ] [ 0.9368948 -0.5916147 -0.2250583 ] [ -0.7933573 0.1448545 -0.6940661 ] [ -0.2298563 -0.2186115 -1.2755966 ] [ 0.3996877 0.5824368 0.5744012 ] [ -0.0329174 -0.8776983 -0.9161253 ] [ 0.9112253 2.0749703 1.4644424 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.699527275544739e-09 -1.487819181660793e-09 -7.722127618163079e-10 ] [ -2.097494329650183e-10 -2.975456676492787e-10 2.489750585408446e-09 ] [ 1.501070944709092e-09 -9.47871240861606e-10 -3.605831465769927e-10 ] [ -1.271098518001012e-09 2.320824933176736e-10 -1.112016478709835e-09 ] [ -3.682703900035911e-10 -3.502542343380192e-10 -2.04373105009197e-09 ] [ 6.403702885613241e-10 9.331666240535653e-10 9.202921735994649e-10 ] [ -5.273948869752192e-11 -1.406227696375905e-09 -1.467794537383386e-09 ] [ 1.459943871941466e-09 3.324468903514362e-09 2.346295375788242e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.222701 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.803516468442879e-18 } }