{ "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" [ 5.39198 0 0 ] "si-unit" "m" "si-value" [ 5.39198e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0815956 5.53401 0 ] "si-unit" "m" "si-value" [ 8.15956e-12 5.534010000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.109849 -0.0410552 5.55668 ] "si-unit" "m" "si-value" [ -1.09849e-11 -4.10552e-12 5.55668e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0600222 -0.0188866 -0.0475744 ] [ 1.35953 1.30974 1.45574 ] [ -0.0201429 2.70129 2.75612 ] [ 1.43727 3.87805 4.08993 ] [ 2.67575 -0.0837777 2.76281 ] [ 3.98871 1.3119 4.2787 ] [ 2.73779 2.77507 0.256836 ] [ 4.26747 4.05038 1.42682 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.00222e-12 -1.88866e-12 -4.75744e-12 ] [ 1.35953e-10 1.30974e-10 1.45574e-10 ] [ -2.01429e-12 2.70129e-10 2.75612e-10 ] [ 1.43727e-10 3.87805e-10 4.08993e-10 ] [ 2.67575e-10 -8.37777e-12 2.76281e-10 ] [ 3.98871e-10 1.3119e-10 4.2787e-10 ] [ 2.73779e-10 2.77507e-10 2.56836e-11 ] [ 4.26747e-10 4.05038e-10 1.42682e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.0986586000000003 -1.3964486000000003 0.6777597000000001 ] [ -0.6369348000000001 -0.24365890000000007 -0.5572675000000001 ] [ 0.5663545000000001 -1.8038704000000005 1.4361671000000003 ] [ -0.26020390000000004 1.7764435000000005 1.0376989000000003 ] [ 0.6496048000000001 -0.6434111000000001 0.6830298000000001 ] [ -1.1745004000000003 1.1603750000000002 -1.0936278000000001 ] [ 0.29612640000000007 -0.7580160000000002 -1.5814501000000005 ] [ -1.5391051000000004 1.9085866000000005 -0.6023101000000001 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.362421771663153e-09 -2.237357317502013e-09 1.08589075480685e-09 ] [ -1.020482053941463e-09 -3.903845962461427e-10 -8.928409673875952e-10 ] [ 9.07399946460753e-10 -2.890119005644234e-09 2.300993370139541e-09 ] [ -4.168926086556726e-10 2.84617626732118e-09 1.662576930707503e-09 ] [ 1.040781631894243e-09 -1.030858230476238e-09 1.094334385885693e-09 ] [ -1.881757097503654e-09 1.85912571167775e-09 -1.752184907452825e-09 ] [ 4.744467987905377e-10 -1.214475523398144e-09 -2.533762398056964e-09 ] [ -2.465918228490234e-09 3.057892854485505e-09 -9.650071686422035e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -25.79072207419016 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.132129228125549e-18 } }