{ "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" [ 5.43103 0 0 ] "si-unit" "m" "si-value" [ 5.43103e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00138287 5.43667 0 ] "si-unit" "m" "si-value" [ 1.38287e-13 5.43667e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0279747 -0.147199 5.47761 ] "si-unit" "m" "si-value" [ -2.79747e-12 -1.47199e-11 5.477610000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0723979 0.065909 0.162895 ] [ 1.32756 1.26807 1.42197 ] [ -0.0160699 2.71544 2.70238 ] [ 1.33005 4.08077 4.07687 ] [ 2.7682 0.027954 2.60436 ] [ 4.1716 1.44154 4.20195 ] [ 2.84836 2.7461 0.066427 ] [ 4.17903 4.06877 1.34805 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -7.239790000000001e-12 6.5909e-12 1.62895e-11 ] [ 1.32756e-10 1.26807e-10 1.42197e-10 ] [ -1.60699e-12 2.71544e-10 2.70238e-10 ] [ 1.33005e-10 4.08077e-10 4.07687e-10 ] [ 2.7682e-10 2.7954e-12 2.60436e-10 ] [ 4.1716e-10 1.44154e-10 4.20195e-10 ] [ 2.84836e-10 2.7461e-10 6.6427e-12 ] [ 4.17903e-10 4.06877e-10 1.34805e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.0680705 0.1994789 -2.8850765 ] [ 0.9481141 2.1665884 -0.5063588 ] [ 0.9265681 -0.2281994 0.8082947 ] [ 0.8544899 0.0009072 0.6698772 ] [ 0.5718475 -0.5305383 2.4838811 ] [ -0.3474799 -1.9160304 -1.3189287 ] [ -2.7625052 0.4075783 -0.2398105 ] [ -1.259105 -0.0997846 0.9881216 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.711237584466166e-09 3.196004299229011e-10 -4.622402117519491e-09 ] [ 1.519046244870833e-09 3.471257281376479e-09 -8.11276231096343e-10 ] [ 1.484525747399076e-09 -3.656157435605875e-10 1.29503087105655e-09 ] [ 1.36904374048973e-09 1.45349463038976e-12 1.073261588646966e-09 ] [ 9.16200695162928e-10 -8.500160606989767e-10 3.979616227266987e-09 ] [ -5.56724171977922e-10 -3.069819111622072e-09 -2.113156727642137e-09 ] [ -4.426021246278428e-09 6.530124234054086e-10 -3.842187765223584e-10 ] [ -2.017308594132384e-09 -1.598725532358797e-10 1.583145326027489e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.678067 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.7162564822736e-18 } }