{ "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" [ 5.39143 0 0 ] "si-unit" "m" "si-value" [ 5.39143e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.144963 5.17841 0 ] "si-unit" "m" "si-value" [ 1.44963e-11 5.178410000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.144779 0.421312 5.38784 ] "si-unit" "m" "si-value" [ -1.44779e-11 4.21312e-11 5.38784e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.15223 0.0692904 -0.00428898 ] [ 1.42734 1.24068 1.17973 ] [ -0.332931 2.76994 2.80275 ] [ 1.2591 4.25807 3.96691 ] [ 2.6931 0.104845 2.7319 ] [ 4.09744 1.52781 4.38962 ] [ 2.50984 2.47613 -0.202936 ] [ 4.16866 4.11218 1.07304 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5223e-11 6.929040000000001e-12 -4.288980000000001e-13 ] [ 1.42734e-10 1.24068e-10 1.17973e-10 ] [ -3.32931e-11 2.76994e-10 2.80275e-10 ] [ 1.2591e-10 4.25807e-10 3.96691e-10 ] [ 2.6931e-10 1.04845e-11 2.7319e-10 ] [ 4.09744e-10 1.52781e-10 4.38962e-10 ] [ 2.50984e-10 2.47613e-10 -2.02936e-11 ] [ 4.16866e-10 4.11218e-10 1.07304e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.1591289 -2.9242072 0.4172782 ] [ -1.1483213 0.4495803 1.4917308 ] [ 2.4794101 0.7354654 -0.5939845 ] [ -1.740852 0.1172351 0.1837605 ] [ 0.6972031 0.7619813 -0.3443248 ] [ -4.2791677 1.9851469 -3.8214262 ] [ 3.4261118 0.2695623 1.1366787 ] [ -1.5935128 -1.3947641 1.5302873 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.459305844873621e-09 -4.68509641021503e-09 6.685533764095065e-10 ] [ -1.839813540026663e-09 7.203070458322502e-10 2.39001621228728e-09 ] [ 3.97245289559539e-09 1.17834546928732e-09 -9.516680790175777e-10 ] [ -2.789152374672922e-09 1.878313363571501e-10 2.944167769265184e-10 ] [ 1.117042506769285e-09 1.220828624346791e-09 -5.516691445216358e-10 ] [ -6.855982445422509e-09 3.180555952033596e-09 -6.122599715752585e-09 ] [ 5.489236226207006e-09 4.318864149090758e-10 1.821160038501337e-09 ] [ -2.553088953105546e-09 -2.234658432551153e-09 2.451790535167156e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.389816 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.509855918881378e-18 } }