{ "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" [ 5.46438 0 0 ] "si-unit" "m" "si-value" [ 5.46438e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0372754 5.43203 0 ] "si-unit" "m" "si-value" [ 3.72754e-12 5.432030000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.17857 -0.0223871 5.50346 ] "si-unit" "m" "si-value" [ 1.7857e-11 -2.23871e-12 5.503459999999999e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00726127 0.010583 0.00336114 ] [ 1.28417 1.2786 1.26313 ] [ 0.0794421 2.71348 2.73185 ] [ 1.57701 4.05847 4.12903 ] [ 2.78941 -0.159624 2.68623 ] [ 4.22148 1.3448 3.91745 ] [ 2.73822 2.68922 0.00939316 ] [ 4.14349 4.04668 1.21083 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.26127e-13 1.0583e-12 3.36114e-13 ] [ 1.28417e-10 1.2786e-10 1.26313e-10 ] [ 7.944210000000001e-12 2.71348e-10 2.73185e-10 ] [ 1.57701e-10 4.05847e-10 4.12903e-10 ] [ 2.78941e-10 -1.59624e-11 2.68623e-10 ] [ 4.22148e-10 1.3448e-10 3.91745e-10 ] [ 2.73822e-10 2.68922e-10 9.39316e-13 ] [ 4.14349e-10 4.04668e-10 1.21083e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.6905911 0.8907741 -2.1489055 ] [ 1.7237631 0.3143854 1.6039268 ] [ 1.2147087 2.2851222 0.1413297 ] [ -0.8113704 -1.219479 0.1268093 ] [ -0.2850836 1.7990297 -0.4947395 ] [ -0.9871355 -1.5779271 0.7406583 ] [ 0.0103712 -1.625912 -0.0507488 ] [ 0.8253376 -0.8659933 0.0816698 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.708625535752555e-09 1.427177437434161e-09 -3.442926152408535e-09 ] [ 2.761772938617733e-09 5.037009378008563e-10 2.569774020434558e-09 ] [ 1.946177880222361e-09 3.661169364511062e-09 2.264351411646778e-10 ] [ -1.299958685689145e-09 -1.953820743356563e-09 2.031708957600135e-10 ] [ -4.567542788934988e-10 2.882363325464838e-09 -7.926600602862816e-10 ] [ -1.581565419661719e-09 -2.528117908946744e-09 1.186665412261473e-09 ] [ 1.661649416964096e-11 -2.60499819387817e-09 -8.130854089365503e-11 ] [ 1.322336606987182e-09 -1.38747421902944e-09 1.308494441854118e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -217.23805 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.480537248581814e-17 } }