{ "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" [ 5.37815 0 0 ] "si-unit" "m" "si-value" [ 5.37815e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0312137 5.76118 0 ] "si-unit" "m" "si-value" [ 3.12137e-12 5.761180000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.42726 0.0546964 4.8758 ] "si-unit" "m" "si-value" [ 4.2726e-11 5.469640000000001e-12 4.8758e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0437527 -0.0672423 0.175944 ] [ 1.47307 1.39309 1.21037 ] [ 0.198849 2.42305 2.74052 ] [ 1.63292 4.13291 3.99992 ] [ 2.96978 -0.0953104 2.87815 ] [ 4.41344 1.46946 3.21135 ] [ 3.02165 2.84712 -0.591788 ] [ 4.21555 4.28981 0.802839 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.37527e-12 -6.724230000000001e-12 1.75944e-11 ] [ 1.47307e-10 1.39309e-10 1.21037e-10 ] [ 1.98849e-11 2.42305e-10 2.74052e-10 ] [ 1.63292e-10 4.13291e-10 3.99992e-10 ] [ 2.96978e-10 -9.531040000000001e-12 2.878150000000001e-10 ] [ 4.41344e-10 1.46946e-10 3.21135e-10 ] [ 3.02165e-10 2.84712e-10 -5.91788e-11 ] [ 4.215550000000001e-10 4.28981e-10 8.02839e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 9.058146 14.1628681 -6.5462476 ] [ 4.6021252 -1.1157277 -2.5394991 ] [ 36.9635238 29.6542398 -19.4254907 ] [ -3.8708848 -1.7898119 -2.8506575 ] [ -0.569452 -3.9625505 -7.7799198 ] [ -29.3241606 -28.6816991 17.446537 ] [ -4.7818378 3.9152166 10.5114858 ] [ -12.0774597 -12.1825353 11.1837918 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.451274974899304e-08 2.269141615329412e-08 -1.048824485868811e-08 ] [ 7.373417401434524e-09 -1.787592836118956e-09 -4.068726086562641e-09 ] [ 5.922209365474437e-08 4.751132971515686e-08 -3.112306704710783e-08 ] [ -6.201841128370084e-09 -2.867594781809627e-09 -4.567256800408176e-09 ] [ -9.123626810678015e-10 -6.34870576983935e-09 -1.246480561525901e-08 ] [ -4.698248453790449e-08 -4.59531477428404e-08 2.795243369532217e-08 ] [ -7.661348727617706e-09 6.272868501888066e-09 1.684125679863119e-08 ] [ -1.935022356999419e-08 -1.951857323973071e-08 1.791840975385475e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -11.936267 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.912400792702655e-18 } }