{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.46856e-10 0.0 0.0 ] "source-value" [ 5.46856 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.09414e-11 5.47364e-10 0.0 ] "source-value" [ 0.109414 5.47364 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 8.53482e-12 1.88746e-11 5.50226e-10 ] "source-value" [ 0.0853482 0.188746 5.50226 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -2.073797816993226e-09 -1.858544747118098e-09 -1.352584259628927e-09 ] [ -1.232926179357466e-10 -2.680923741761261e-10 3.100674309638425e-09 ] [ 1.617242368218369e-09 -1.400867294055694e-09 -2.553944835856378e-10 ] [ -1.546882141045288e-09 5.855216945601811e-10 -1.108048688308424e-09 ] [ -6.265207534158049e-10 -5.72233401884928e-10 -2.318454032213276e-09 ] [ 8.646293534396314e-10 1.324974590793329e-09 1.553919862069814e-09 ] [ -2.75744690152391e-10 -2.081003446127612e-09 -2.275755224180646e-09 ] [ 2.164366137666795e-09 4.270244978008948e-09 2.655642516208671e-09 ] ] "source-value" [ [ -1.2943628 -1.1600124 -0.8442167 ] [ -0.0769532 -0.1673301 1.9352887 ] [ 1.0094033 -0.8743526 -0.1594047 ] [ -0.9654879 0.3654539 -0.6915896 ] [ -0.3910435 -0.35716 -1.4470652 ] [ 0.5396592 0.8269841 0.9698805 ] [ -0.1721063 -1.2988602 -1.4204147 ] [ 1.3508911 2.6652773 1.6575217 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.808836976565231e-18 "source-value" -36.255909 } }