{ "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" [ 5.4419 0 0 ] "si-unit" "m" "si-value" [ 5.441900000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.361794 5.44502 0 ] "si-unit" "m" "si-value" [ 3.61794e-11 5.44502e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0366443 0.298499 5.53333 ] "si-unit" "m" "si-value" [ 3.66443e-12 2.98499e-11 5.53333e-10 ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.3253579999999996 -1.5824693999999997 5.454553099999999 ] [ -0.49101729999999993 -0.6350096999999999 0.37665029999999994 ] [ -0.05998259999999999 -3.1299115999999993 -1.2754163999999997 ] [ 3.5173777999999998 -0.11519069999999998 0.8147546999999999 ] [ -1.3383774999999998 1.8573746999999998 0.9502147999999999 ] [ -3.4448834999999995 3.3963775999999997 -2.5573888999999994 ] [ -0.6093001999999998 -0.4659675999999999 -0.9631845999999998 ] [ 0.10082529999999999 0.6747966999999999 -2.8001830999999995 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.725634222590246e-09 -2.535395475811403e-09 8.739157453732164e-09 ] [ -7.866964384683398e-10 -1.017397695321222e-09 6.034603048773062e-10 ] [ -9.610271937479806e-11 -5.01467119069072e-09 -2.043442337864901e-09 ] [ 5.635460477680938e-09 -1.845558464735865e-10 1.305380932026918e-09 ] [ -2.144317140304752e-09 2.975842320405414e-09 1.522411937298148e-09 ] [ -5.519311805079677e-09 5.441596786128814e-09 -4.097388705873428e-09 ] [ -9.76206535488764e-10 -7.465623947702859e-10 -1.543191847634599e-09 ] [ 1.615399384451462e-10 1.081143496532991e-09 -4.486387896779268e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.750788240654238 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.363336805754778e-18 } }