{ "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" [ 5.48581 0 0 ] "si-unit" "m" "si-value" [ 5.48581e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00228581 5.44331 0 ] "si-unit" "m" "si-value" [ 2.28581e-13 5.44331e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0206328 -0.0957916 5.42731 ] "si-unit" "m" "si-value" [ -2.06328e-12 -9.57916e-12 5.427310000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00584564 0.00126862 0.0177865 ] [ 1.36937 1.35462 1.37323 ] [ -0.0302415 2.74811 2.64947 ] [ 1.37836 4.07615 4.08107 ] [ 2.65918 -0.0413914 2.54007 ] [ 4.19104 1.29728 4.08084 ] [ 2.79028 2.80414 0.0605432 ] [ 4.08315 4.18517 1.33386 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.845640000000001e-13 1.26862e-13 1.77865e-12 ] [ 1.36937e-10 1.35462e-10 1.37323e-10 ] [ -3.02415e-12 2.74811e-10 2.64947e-10 ] [ 1.37836e-10 4.07615e-10 4.081070000000001e-10 ] [ 2.65918e-10 -4.13914e-12 2.54007e-10 ] [ 4.19104e-10 1.29728e-10 4.08084e-10 ] [ 2.79028e-10 2.80414e-10 6.05432e-12 ] [ 4.08315e-10 4.18517e-10 1.33386e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5884128 0.7244237 -0.2331098 ] [ -0.5644736 1.3337016 -1.5349334 ] [ 0.1676839 0.0404211 0.9756233 ] [ 0.1795147 -0.6432033 -0.5842408 ] [ 0.8943757 0.7887317 3.7537917 ] [ -1.8236935 0.2920291 -1.0240919 ] [ -0.6197634 -1.1796854 -1.2680269 ] [ 1.1779434 -1.3564185 -0.0850122 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.427412315394661e-10 1.160654715693433e-09 -3.734830716393638e-10 ] [ -9.043864049788109e-10 2.136825522643553e-09 -2.459234407965055e-09 ] [ 2.686592242645651e-10 6.476174140701888e-11 1.563120841967744e-09 ] [ 2.876142554299258e-10 -1.030525289681409e-09 -9.360569506774887e-10 ] [ 1.432947836751635e-09 1.263687489823839e-09 6.014237301093087e-09 ] [ -2.921879089204925e-09 4.678821966132652e-10 -1.640776099730651e-09 ] [ -9.929704299075187e-10 -1.890064367779097e-09 -2.0316030537255e-09 ] [ 1.887273376105663e-09 -2.173222008720605e-09 -1.362045593227737e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -36.400651 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.832027201410015e-18 } }