{ "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" [ 5.54692 0 0 ] "si-unit" "m" "si-value" [ 5.54692e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.123956 5.52099 0 ] "si-unit" "m" "si-value" [ 1.23956e-11 5.520990000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.202669 -0.109883 5.46638 ] "si-unit" "m" "si-value" [ 2.02669e-11 -1.09883e-11 5.466380000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.000314992 -0.0047744 0.0104344 ] [ 1.40487 1.33719 1.19876 ] [ 0.131099 2.68123 2.80213 ] [ 1.67848 4.08836 4.2255 ] [ 2.84099 -0.0865799 2.6392 ] [ 4.04763 1.27038 4.03721 ] [ 2.8307 2.64898 -0.0339665 ] [ 4.22323 4.11032 1.34741 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.14992e-14 -4.7744e-13 1.04344e-12 ] [ 1.40487e-10 1.33719e-10 1.19876e-10 ] [ 1.31099e-11 2.68123e-10 2.80213e-10 ] [ 1.67848e-10 4.08836e-10 4.225500000000001e-10 ] [ 2.84099e-10 -8.65799e-12 2.639200000000001e-10 ] [ 4.04763e-10 1.27038e-10 4.03721e-10 ] [ 2.8307e-10 2.64898e-10 -3.39665e-12 ] [ 4.22323e-10 4.11032e-10 1.34741e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.7413419 0.4816673 -0.9408706 ] [ 0.4298672 -0.1515061 3.4719353 ] [ -0.6492584 0.582404 -0.7973816 ] [ -0.480706 -1.6978917 -2.9023752 ] [ -2.9609865 0.6805088 0.7165646 ] [ 6.2095031 -1.3363376 -0.7657913 ] [ -2.2129913 3.2096303 1.4754735 ] [ 2.4059137 -1.768475 -0.2575547 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.392113901799452e-09 7.717160870638599e-10 -1.507440878518069e-09 ] [ 6.887231778887578e-10 -2.427395313285869e-10 5.562653566590234e-09 ] [ -1.040226629338015e-09 9.331140726604033e-10 -1.277546157376097e-09 ] [ -7.701759146782849e-10 -2.720322386390367e-09 -4.650117690229724e-09 ] [ -4.74402334480442e-09 1.090295289608663e-09 1.148063049412904e-09 ] [ 9.948720693605124e-09 -2.141048860215982e-09 -1.226932917272039e-09 ] [ -3.545602922893799e-09 5.14239462807129e-09 2.363969146309949e-09 ] [ 3.854698681802426e-09 -2.83340929946928e-09 -4.126481189171578e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -34.994947 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.606808592953511e-18 } }