{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.42802e-10 0.0 0.0 ] "source-value" [ 5.42802 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -4.76613e-12 5.42825e-10 0.0 ] "source-value" [ -0.0476613 5.42825 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -9.87222e-12 -1.86163e-11 5.49756e-10 ] "source-value" [ -0.0987222 -0.186163 5.49756 ] } "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" [ [ 2.466279819437361e-09 6.079529042526267e-09 -2.101797295400665e-09 ] [ 9.500543667251079e-10 -2.489330174263148e-09 -4.259524333586189e-10 ] [ -1.906101194447332e-09 5.676964382389777e-09 -1.934243747227008e-10 ] [ -9.92634453470137e-10 -3.81274280306886e-09 8.411092404286254e-10 ] [ -1.510189092075727e-09 1.210620195789702e-09 -3.982754731049472e-10 ] [ 2.837237700504682e-09 -4.123298625532021e-09 1.066039617311048e-09 ] [ -4.800725657155827e-09 1.905151584364184e-09 -3.193034344427035e-09 ] [ 2.956078510481873e-09 -4.4468936022059e-09 4.405335223491956e-09 ] ] "source-value" [ [ 1.5393307999999997 3.794543599999999 -1.3118386999999998 ] [ 0.5929772999999999 -1.5537176999999995 -0.26585859999999994 ] [ -1.1896947999999998 3.5432824999999992 -0.12072599999999997 ] [ -0.6195536999999999 -2.3797268999999996 0.5249790999999999 ] [ -0.9425858999999998 0.7556096999999998 -0.24858399999999994 ] [ 1.7708644999999996 -2.5735605999999995 0.6653695999999999 ] [ -2.9963772999999994 1.1891020999999997 -1.9929352999999996 ] [ 1.8450390999999995 -2.7755326999999994 2.7495939999999996 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -3.06296e-12 -6.385200000000001e-12 -4.907190000000001e-12 ] [ 1.36252e-10 1.37203e-10 1.3263e-10 ] [ 3.67903e-12 2.58342e-10 2.70389e-10 ] [ 1.37777e-10 4.04701e-10 4.07282e-10 ] [ 2.72906e-10 4.01884e-14 2.69217e-10 ] [ 4.00266e-10 1.36136e-10 4.06132e-10 ] [ 2.83534e-10 2.75342e-10 3.818810000000001e-12 ] [ 4.01886e-10 4.16847e-10 1.28111e-10 ] ] "source-value" [ [ -0.0306296 -0.063852 -0.0490719 ] [ 1.36252 1.37203 1.3263 ] [ 0.0367903 2.58342 2.70389 ] [ 1.37777 4.04701 4.07282 ] [ 2.72906 0.000401884 2.69217 ] [ 4.00266 1.36136 4.06132 ] [ 2.83534 2.75342 0.0381881 ] [ 4.01886 4.16847 1.28111 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.718795611782243e-18 "source-value" -35.693915 } }