{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.30636e-10 0.0 0.0 ] "source-value" [ 5.30636 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -7.81877e-12 5.44815e-10 0.0 ] "source-value" [ -0.0781877 5.44815 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -2.00818e-13 -9.686720000000001e-12 5.44923e-10 ] "source-value" [ -0.00200818 -0.0968672 5.44923 ] } "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" [ [ 1.660140326804965e-09 6.61841441979054e-09 -5.869475676656283e-09 ] [ 1.426735717339807e-09 1.051611375970095e-09 1.867789947090762e-09 ] [ 4.965287621143128e-09 6.468603695950946e-09 -1.070558989057702e-08 ] [ 2.867772783632198e-09 -8.71642400944197e-10 2.754519885055371e-09 ] [ -1.842298836400848e-09 -3.390336307007395e-09 -6.755282600669649e-09 ] [ -2.257648385318336e-09 -6.059920803952606e-09 1.206413408701766e-08 ] [ -5.465406092019874e-09 -3.019070167158232e-09 -5.522234015018354e-09 ] [ -1.3545832953987e-09 -7.976601330844742e-10 1.216613842397517e-08 ] ] "source-value" [ [ 1.0361781000000003 4.130889400000001 -3.663438600000001 ] [ 0.8904984000000002 0.6563642000000001 1.1657828000000001 ] [ 3.099088800000001 4.037384900000001 -6.681903700000002 ] [ 1.7899230000000004 -0.5440364000000001 1.7192361000000005 ] [ -1.1498725000000003 -2.1160815000000004 -4.216315800000001 ] [ -1.4091133000000002 -3.7823051000000008 7.529840300000002 ] [ -3.411238200000001 -1.8843554000000005 -3.446707400000001 ] [ -0.8454644000000002 -0.4978603000000001 7.593506400000002 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -1.83636e-12 7.04735e-13 1.68371e-12 ] [ 1.29138e-10 1.3449e-10 1.40641e-10 ] [ -6.14737e-12 2.687530000000001e-10 2.83465e-10 ] [ 1.25782e-10 4.05715e-10 4.117560000000001e-10 ] [ 2.70205e-10 2.50121e-12 2.83894e-10 ] [ 3.96698e-10 1.43423e-10 4.044520000000001e-10 ] [ 2.67871e-10 2.79142e-10 9.589180000000001e-12 ] [ 4.00247e-10 4.11579e-10 1.29634e-10 ] ] "source-value" [ [ -0.0183636 0.00704735 0.0168371 ] [ 1.29138 1.3449 1.40641 ] [ -0.0614737 2.68753 2.83465 ] [ 1.25782 4.05715 4.11756 ] [ 2.70205 0.0250121 2.83894 ] [ 3.96698 1.43423 4.04452 ] [ 2.67871 2.79142 0.0958918 ] [ 4.00247 4.11579 1.29634 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.642637748289136e-18 "source-value" -35.218575 } }