{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.441900000000001e-10 0.0 0.0 ] "source-value" [ 5.4419 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 3.61794e-11 5.44502e-10 0.0 ] "source-value" [ 0.361794 5.44502 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 3.66443e-12 2.98499e-11 5.53333e-10 ] "source-value" [ 0.0366443 0.298499 5.53333 ] } "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" [ [ 5.995486387229217e-09 -3.554368110750872e-09 1.182833822894596e-08 ] [ -1.479061844469162e-09 -1.515598841435858e-09 8.203307720511321e-10 ] [ 4.884390839641018e-09 -1.232710221970748e-08 -6.334626001913423e-09 ] [ 1.215564272514997e-08 -5.135334476574073e-09 4.534503023096175e-09 ] [ -6.515108154110962e-09 7.803803057502896e-09 2.934971275461792e-10 ] [ -1.215517408848839e-08 1.23802866328526e-08 -2.070659473428403e-09 ] [ -2.70981290884623e-09 -2.309536156924242e-09 -2.382954618831105e-09 ] [ -1.763629561054637e-10 4.657850275254692e-09 -6.688429217684176e-09 ] ] "source-value" [ [ 3.7420882999999994 -2.2184620999999995 7.382668099999999 ] [ -0.9231577999999999 -0.9459623999999999 0.5120101999999999 ] [ 3.0485969999999996 -7.693972099999999 -3.9537625999999997 ] [ 7.586955499999999 -3.2052236999999995 2.8302141999999995 ] [ -4.066410699999999 4.870750799999999 0.18318649999999997 ] [ -7.586662999999999 7.727167199999999 -1.2924039999999999 ] [ -1.6913321999999997 -1.4414990999999997 -1.4873232999999997 ] [ -0.11007709999999998 2.9072014999999998 -4.174589199999999 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -1.28377e-11 -1.50066e-11 -1.70326e-11 ] [ 1.39649e-10 1.37402e-10 1.31098e-10 ] [ -5.42726e-12 2.97617e-10 3.14736e-10 ] [ 1.41657e-10 4.24499e-10 4.02908e-10 ] [ 2.7363e-10 -2.34712e-11 2.6251e-10 ] [ 4.24505e-10 1.08558e-10 3.99518e-10 ] [ 2.94651e-10 2.56191e-10 -3.54123e-13 ] [ 4.33312e-10 3.8007e-10 1.43779e-10 ] ] "source-value" [ [ -0.128377 -0.150066 -0.170326 ] [ 1.39649 1.37402 1.31098 ] [ -0.0542726 2.97617 3.14736 ] [ 1.41657 4.24499 4.02908 ] [ 2.7363 -0.234712 2.6251 ] [ 4.24505 1.08558 3.99518 ] [ 2.94651 2.56191 -0.00354123 ] [ 4.33312 3.8007 1.43779 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -4.823315546420798e-18 "source-value" -30.104768 } }