{ "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" [ 5.46497 0 0 ] "si-unit" "m" "si-value" [ 5.46497e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00264453 5.45437 0 ] "si-unit" "m" "si-value" [ 2.64453e-13 5.45437e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.00434361 0.134648 5.52148 ] "si-unit" "m" "si-value" [ -4.343610000000001e-13 1.34648e-11 5.521480000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.000601708 -0.00129581 -0.00103934 ] [ 1.36071 1.38338 1.29931 ] [ 0.0379757 2.81246 2.65752 ] [ 1.43056 4.2109 3.80234 ] [ 2.71672 0.059655 2.71923 ] [ 4.18219 1.40754 3.91392 ] [ 2.71688 2.7266 0.0375018 ] [ 4.08381 4.07468 1.29537 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.017079999999999e-14 -1.29581e-13 -1.03934e-13 ] [ 1.36071e-10 1.38338e-10 1.29931e-10 ] [ 3.79757e-12 2.812460000000001e-10 2.65752e-10 ] [ 1.43056e-10 4.2109e-10 3.80234e-10 ] [ 2.71672e-10 5.9655e-12 2.71923e-10 ] [ 4.18219e-10 1.40754e-10 3.91392e-10 ] [ 2.71688e-10 2.7266e-10 3.75018e-12 ] [ 4.08381e-10 4.07468e-10 1.29537e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 4.2510114 -4.1495155 -6.2643851 ] [ -0.1236357 -0.2125293 0.4908649 ] [ -0.1384268 -0.4015219 -0.8578412 ] [ -2.8302822 -0.7204697 13.0710769 ] [ 1.9876748 1.4258768 -2.6974021 ] [ -4.7075891 4.3350169 6.5577557 ] [ 1.4904941 -1.091321 -10.8192128 ] [ 0.0707535 0.8144638 0.5191437 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.810871135947627e-09 -6.648256776520826e-09 -1.003665143359775e-08 ] [ -1.980862296682338e-10 -3.405094785003761e-10 7.864522732307465e-10 ] [ -2.217841844793911e-10 -6.433090062192845e-10 -1.374413126322521e-09 ] [ -4.534612008466114e-09 -1.15431971884499e-09 2.094217399039715e-08 ] [ 3.184606120550623e-09 2.284506491922691e-09 -4.321714617122531e-09 ] [ -7.542389258493088e-09 6.945462785175114e-09 1.050668295402031e-08 ] [ 2.388034820134859e-09 -1.748489006393514e-09 -1.733428994643372e-08 ] [ 1.13359604473719e-10 1.304914869598849e-09 8.317599058283056e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -34.240926 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.486001156372308e-18 } }