{ "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" [ [ 15.3017484 -16.1410484 8.9571412 ] [ 0.5340829 0.8495928 6.4721697 ] [ 2.5929712 1.563927 -1.8549679 ] [ -4.4112693 1.9400822 -1.636262 ] [ 1.9091787 1.5860855 -0.4456688 ] [ -21.1715706 15.1630679 -15.9708694 ] [ 8.6053665 -1.2049117 1.1696059 ] [ -3.3605078 -3.7567953 3.3088512 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.451610354384381e-08 -2.586081038168125e-08 1.435092221984446e-08 ] [ 8.556951359490644e-10 1.36119772136001e-09 1.036955897919015e-08 ] [ 4.154397835047721e-09 2.505687276037882e-09 -2.971986201714472e-09 ] [ -7.067632540512781e-09 3.10835434327023e-09 -2.62158072190345e-09 ] [ 3.058841478069337e-09 2.541189106689879e-09 -7.14040131979991e-10 ] [ -3.392059544093663e-08 2.429391288898295e-08 -2.558815356653012e-08 ] [ 1.378731701971552e-08 -1.930481355868383e-09 1.873915228529743e-09 ] [ -5.384127031176042e-09 -6.019049598791323e-09 5.301364034346025e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -28.943437 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.637249808699769e-18 } }