{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.45078e-10 0.0 0.0 ] "source-value" [ 5.45078 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.24172e-11 5.56718e-10 0.0 ] "source-value" [ 0.124172 5.56718 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -7.70044e-12 3.88551e-12 5.42613e-10 ] "source-value" [ -0.0770044 0.0388551 5.42613 ] } "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" [ [ -6.640429287866304e-10 6.750916989813293e-10 2.712827564375927e-09 ] [ -2.485948460069626e-09 -1.117063495283017e-09 4.11234678702288e-10 ] [ 5.343579465692159e-12 -7.155364047261563e-10 -7.99403781900891e-10 ] [ 1.749998402582533e-09 3.451538652833645e-10 -3.126131774619303e-10 ] [ -2.102838229551199e-09 -8.589073398561063e-10 2.814074232009466e-10 ] [ 1.76903562540854e-09 -3.386326860013843e-10 3.501342313091213e-10 ] [ -4.753590742495527e-10 7.47671581644866e-10 -1.886980658437043e-09 ] [ 2.203811085200243e-09 1.262222779957104e-09 -7.566062797884192e-10 ] ] "source-value" [ [ -0.41446300000000014 0.4213591000000001 1.6932138000000005 ] [ -1.5516070000000004 -0.6972162000000001 0.2566725000000001 ] [ 0.003335200000000001 -0.44660270000000013 -0.49894860000000013 ] [ 1.0922631000000003 0.21542810000000007 -0.19511780000000006 ] [ -1.3124884000000003 -0.5360878000000001 0.17564070000000004 ] [ 1.1041452000000003 -0.21135790000000004 0.21853660000000005 ] [ -0.29669580000000007 0.4666599000000001 -1.1777607000000003 ] [ 1.3755107000000002 0.7878175000000002 -0.4722365000000001 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -4.1219e-12 -9.108e-12 -1.41264e-11 ] [ 1.43794e-10 1.32483e-10 1.35293e-10 ] [ -7.165440000000001e-13 2.71531e-10 2.76218e-10 ] [ 1.33045e-10 4.09617e-10 4.06457e-10 ] [ 2.76499e-10 -4.09375e-12 2.74385e-10 ] [ 3.91349e-10 1.4388e-10 4.069950000000001e-10 ] [ 2.74821e-10 2.70058e-10 1.27143e-11 ] [ 4.06928e-10 4.06454e-10 1.39302e-10 ] ] "source-value" [ [ -0.041219 -0.09108 -0.141264 ] [ 1.43794 1.32483 1.35293 ] [ -0.00716544 2.71531 2.76218 ] [ 1.33045 4.09617 4.06457 ] [ 2.76499 -0.0409375 2.74385 ] [ 3.91349 1.4388 4.06995 ] [ 2.74821 2.70058 0.127143 ] [ 4.06928 4.06454 1.39302 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.823696203417178e-18 "source-value" -36.348653 } }