{ "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" [ 5.30636 0 0 ] "si-unit" "m" "si-value" [ 5.30636e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0781877 5.44815 0 ] "si-unit" "m" "si-value" [ -7.81877e-12 5.44815e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.00200818 -0.0968672 5.44923 ] "si-unit" "m" "si-value" [ -2.00818e-13 -9.686720000000001e-12 5.44923e-10 ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.6570868000000001 1.8579248000000004 -1.4716410000000002 ] [ 0.6946870000000002 0.3198944000000001 0.7302016000000001 ] [ 1.4485922000000002 1.7056394000000004 -3.214607300000001 ] [ 1.0397786000000002 -0.18903590000000006 1.0240433000000002 ] [ -0.7961351000000002 -0.8895367000000002 -2.4026758000000004 ] [ -0.5245266000000001 -1.9404946000000005 3.423815700000001 ] [ -1.7771915000000005 -0.6639356000000001 -1.6815113000000004 ] [ -0.7422913000000001 -0.20045560000000007 3.5923749000000007 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.052769117469831e-09 2.976723702289123e-09 -2.357828823836394e-09 ] [ 1.113011279343558e-09 5.125273330274497e-10 1.169911941629415e-09 ] [ 2.320900575034655e-09 2.73273559270978e-09 -5.150368703545829e-09 ] [ 1.665908977453232e-09 -3.028689019671606e-10 1.640698247464252e-09 ] [ -1.275549054727254e-09 -1.425194915825468e-09 -3.849511025837258e-09 ] [ -8.403842624314644e-10 -3.109015106523177e-09 5.485557513662355e-09 ] [ -2.847374695443412e-09 -1.06374210480077e-09 -2.694078114666965e-09 ] [ -1.189281776481484e-09 -3.211652784744505e-10 5.755619125348087e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.018097 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.770735341454549e-18 } }