{ "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" [ 5.41852 0 0 ] "si-unit" "m" "si-value" [ 5.418520000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.038783 5.47951 0 ] "si-unit" "m" "si-value" [ 3.8783e-12 5.479510000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.00323821 0.0198894 5.39896 ] "si-unit" "m" "si-value" [ 3.23821e-13 1.98894e-12 5.39896e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0136142 -0.0297439 -0.141562 ] [ 1.34075 1.30471 1.3715 ] [ -0.0280615 2.73239 2.73273 ] [ 1.33689 4.08129 3.93514 ] [ 2.80172 0.157681 2.72105 ] [ 4.07194 1.39009 4.01929 ] [ 2.65272 2.79754 0.0144035 ] [ 4.02421 4.07244 1.32124 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.36142e-12 -2.97439e-12 -1.41562e-11 ] [ 1.34075e-10 1.30471e-10 1.3715e-10 ] [ -2.80615e-12 2.73239e-10 2.73273e-10 ] [ 1.33689e-10 4.08129e-10 3.93514e-10 ] [ 2.80172e-10 1.57681e-11 2.72105e-10 ] [ 4.07194e-10 1.39009e-10 4.01929e-10 ] [ 2.65272e-10 2.79754e-10 1.44035e-12 ] [ 4.02421e-10 4.072440000000001e-10 1.32124e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2375983 -0.3090192 0.9262747 ] [ -0.1222713 1.1424769 -0.3708279 ] [ -0.0922295 -0.5136701 -0.9255311 ] [ 0.7047598 0.9913486 0.6858405 ] [ -1.2184818 -2.1333463 -0.7357025 ] [ 0.1444999 1.0122784 0.7208529 ] [ 0.0551325 -1.2418805 -0.6417136 ] [ 0.7661888 1.0518122 0.340807 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.806744414018247e-10 -4.951033376183194e-10 1.484055668778534e-09 ] [ -1.95900218254823e-10 1.830449778984059e-09 -5.941317917203603e-10 ] [ -1.477679486480736e-10 -8.229902250239981e-10 -1.482864290243307e-09 ] [ 1.129149674839684e-09 1.588315549982811e-09 1.098837614697782e-09 ] [ -1.952223052830301e-09 -3.417997565930183e-09 -1.178725345364112e-09 ] [ 2.315143614879379e-10 1.621848786220831e-09 1.15493366341588e-09 ] [ 8.8332002546256e-11 -1.989711902927414e-09 -1.028138527169403e-09 ] [ 1.227569782478807e-09 1.685188916312214e-09 5.460330076049856e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -37.060491 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.937745223556881e-18 } }