{ "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" [ 5.43182 0 0 ] "si-unit" "m" "si-value" [ 5.43182e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00436542 5.42411 0 ] "si-unit" "m" "si-value" [ -4.36542e-13 5.42411e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.250705 -0.013062 5.36378 ] "si-unit" "m" "si-value" [ 2.50705e-11 -1.3062e-12 5.36378e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00336868 -0.0347308 0.0739509 ] [ 1.33721 1.36002 1.29514 ] [ 0.0804819 2.71297 2.74807 ] [ 1.4297 4.00589 4.14244 ] [ 2.76212 -0.0429027 2.66501 ] [ 4.31635 1.33651 3.99144 ] [ 2.62716 2.67896 0.144482 ] [ 3.97118 3.97277 1.25678 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.36868e-13 -3.47308e-12 7.395090000000001e-12 ] [ 1.33721e-10 1.36002e-10 1.29514e-10 ] [ 8.04819e-12 2.71297e-10 2.74807e-10 ] [ 1.4297e-10 4.00589e-10 4.14244e-10 ] [ 2.76212e-10 -4.29027e-12 2.66501e-10 ] [ 4.31635e-10 1.33651e-10 3.99144e-10 ] [ 2.62716e-10 2.67896e-10 1.44482e-11 ] [ 3.97118e-10 3.97277e-10 1.25678e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.6909291 1.3969674 0.4674116 ] [ -1.3776289 -2.3914778 3.2301718 ] [ 0.9878073 2.1105502 -2.7939204 ] [ 2.4732398 -1.3106737 -1.9375821 ] [ -0.1819217 0.7434214 0.8571488 ] [ -3.2276673 -2.6429512 2.7718102 ] [ 0.1951258 -0.2707658 -5.6866333 ] [ 3.8219741 2.3649295 3.0915934 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.311343692250385e-09 2.238188508299762e-09 7.488759378107212e-10 ] [ -2.207204815718421e-09 -3.831569820322218e-09 5.175305739127454e-09 ] [ 1.582641761915572e-09 3.381474187464764e-09 -4.476353945256185e-09 ] [ 3.962566985192068e-09 -2.099930759637433e-09 -3.104348741500568e-09 ] [ -2.914706945561913e-10 1.191092386482405e-09 1.373303767906775e-09 ] [ -5.17129308778066e-09 -4.234474622555305e-09 4.440929499734972e-09 ] [ 3.126259948748966e-10 -4.338146344722087e-10 -9.110990924322751e-09 ] [ 6.123477548323121e-09 3.789034754740234e-09 4.953278666499583e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.479261 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.684404249746123e-18 } }