{ "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" [ [ -2.0578814 0.8015605 -0.7750996 ] [ -0.1329748 -1.4312349 2.9067197 ] [ -0.1792944 1.1379486 -2.0170229 ] [ 1.9536786 -0.4023563 -1.1012719 ] [ -0.1740908 0.6658134 0.6192894 ] [ -2.247611 -1.5437969 1.8729894 ] [ 0.2931579 -0.3956516 -4.4303033 ] [ 2.5450158 1.1677172 2.9246994 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.297089467459173e-09 1.284241493256758e-09 -1.241846457911432e-09 ] [ -2.130491157155558e-10 -2.293091095653026e-09 4.65707834655879e-09 ] [ -2.872612959203635e-10 1.823194642592091e-09 -3.231626933998216e-09 ] [ 3.130138177477275e-09 -6.446458570915911e-10 -1.764432091323996e-09 ] [ -2.789242096563686e-10 1.066750663295359e-09 9.922109981892596e-10 ] [ -3.601069796852909e-09 -2.473435300443516e-09 3.00085982768622e-09 ] [ 4.696907335828244e-10 -6.339037435021133e-10 -7.098128370313089e-09 ] [ 4.077564814326608e-09 1.870889197546038e-09 4.685885001547788e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.794692 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.734941867113679e-18 } }