{ "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" [ 5.51396 0 0 ] "si-unit" "m" "si-value" [ 5.51396e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0181329 5.46551 0 ] "si-unit" "m" "si-value" [ 1.81329e-12 5.46551e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.147171 -0.00272143 5.46493 ] "si-unit" "m" "si-value" [ 1.47171e-11 -2.72143e-13 5.46493e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0812176 -0.117418 -0.0378641 ] [ 1.41633 1.35692 1.32004 ] [ 0.0825096 2.73802 2.72856 ] [ 1.5042 4.09281 4.08646 ] [ 2.79856 -0.0135645 2.62504 ] [ 4.22175 1.43085 4.07963 ] [ 2.7526 2.68069 -0.168753 ] [ 4.2604 4.00574 1.18537 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -8.12176e-12 -1.17418e-11 -3.78641e-12 ] [ 1.41633e-10 1.35692e-10 1.32004e-10 ] [ 8.25096e-12 2.73802e-10 2.72856e-10 ] [ 1.5042e-10 4.09281e-10 4.08646e-10 ] [ 2.79856e-10 -1.35645e-12 2.62504e-10 ] [ 4.22175e-10 1.43085e-10 4.07963e-10 ] [ 2.7526e-10 2.68069e-10 -1.68753e-11 ] [ 4.2604e-10 4.00574e-10 1.18537e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.3605427 5.553574 -2.2883252 ] [ -1.1532961 -0.6618788 -1.1701227 ] [ 0.6987942 0.7529515 -0.7622482 ] [ -0.3536036 -0.4026174 -1.7511991 ] [ 1.9461364 -0.1742456 0.6182371 ] [ 1.7185017 -5.0339235 -2.9466595 ] [ -1.6053092 2.7395764 4.3451969 ] [ -4.6117661 -2.7734366 3.9551208 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.384182947140108e-09 8.89780642468274e-09 -3.666301136227485e-09 ] [ -1.847784048279819e-09 -1.060446739163159e-09 -1.874743233407372e-09 ] [ 1.119591729990639e-09 1.206361289896291e-09 -1.221256245286883e-09 ] [ -5.665354209507149e-10 -6.45064185407282e-10 -2.805730256386001e-09 ] [ 3.118054240967878e-09 -2.791722265972685e-10 9.905250277311917e-10 ] [ 2.753343246545055e-09 -8.065234542595709e-09 -4.721068960358218e-09 ] [ -2.571988869395151e-09 4.38928525897543e-09 6.961772885952636e-09 ] [ -7.388863826017994e-09 -4.443535279791041e-09 6.336802078199792e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.582266 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.700907470028673e-18 } }