{ "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" [ 5.37928 0 0 ] "si-unit" "m" "si-value" [ 5.37928e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.109609 5.36452 0 ] "si-unit" "m" "si-value" [ -1.09609e-11 5.36452e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.116688 0.583163 5.41925 ] "si-unit" "m" "si-value" [ -1.16688e-11 5.83163e-11 5.41925e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.149607 0.163517 0.168021 ] [ 1.37749 1.37328 1.35818 ] [ 0.000964456 2.92001 2.60942 ] [ 1.4682 4.32928 3.69686 ] [ 2.55926 -0.0770152 2.34173 ] [ 4.30694 1.43375 4.42217 ] [ 2.84059 2.75554 0.271651 ] [ 3.86093 4.12935 1.26521 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.49607e-11 1.63517e-11 1.68021e-11 ] [ 1.37749e-10 1.37328e-10 1.35818e-10 ] [ 9.64456e-14 2.92001e-10 2.60942e-10 ] [ 1.4682e-10 4.32928e-10 3.69686e-10 ] [ 2.55926e-10 -7.70152e-12 2.34173e-10 ] [ 4.30694e-10 1.43375e-10 4.422170000000001e-10 ] [ 2.84059e-10 2.75554e-10 2.71651e-11 ] [ 3.86093e-10 4.12935e-10 1.26521e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 18.693600799999995 -15.213528399999998 18.682324599999998 ] [ -2.9328106999999997 3.0829660999999997 -0.7244504999999999 ] [ 0.21100899999999997 -2.0014896999999996 2.3387503999999995 ] [ -4.991077699999999 -2.9585265999999995 7.897821799999999 ] [ 5.655855399999999 4.598129299999999 1.0180325999999997 ] [ -18.368425099999996 16.854140599999997 -24.748790299999996 ] [ -2.2646365999999998 -5.487887899999999 -8.486042799999998 ] [ 3.9964849999999994 1.1261963999999998 4.022354199999999 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.995045016032817e-08 -2.437475952235683e-08 2.993238369631671e-08 ] [ -4.698880736772082e-09 4.939456208138955e-09 -1.16069765402687e-09 ] [ 3.380736865783872e-10 -3.206740004112005e-09 3.747091212766647e-09 ] [ -7.996588003536235e-09 -4.740082150534912e-09 1.265370544320457e-08 ] [ 9.061679292505432e-09 7.367015263875468e-09 1.631068030932238e-09 ] [ -2.94294612561359e-08 2.700331003299608e-08 -3.965193321174181e-08 ] [ -3.628347815128001e-09 -8.792565690951207e-09 -1.359613937726817e-08 ] [ 6.403074832377888e-09 1.804365542509125e-09 6.444521859816685e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.396863 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.107720041546055e-18 } }