{ "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" [ 5.46308 0 0 ] "si-unit" "m" "si-value" [ 5.46308e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0404011 5.38219 0 ] "si-unit" "m" "si-value" [ -4.04011e-12 5.38219e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0107061 -0.144189 5.56456 ] "si-unit" "m" "si-value" [ 1.07061e-12 -1.44189e-11 5.56456e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0957934 0.00987827 -0.0909378 ] [ 1.38627 1.24986 1.3117 ] [ -0.0751597 2.80438 2.76133 ] [ 1.36904 3.93592 4.18176 ] [ 2.71956 -0.067532 2.7564 ] [ 4.08015 1.26891 4.08099 ] [ 2.56948 2.74723 0.13466 ] [ 4.07358 4.09238 1.48906 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -9.579340000000001e-12 9.87827e-13 -9.09378e-12 ] [ 1.38627e-10 1.24986e-10 1.3117e-10 ] [ -7.51597e-12 2.80438e-10 2.76133e-10 ] [ 1.36904e-10 3.93592e-10 4.18176e-10 ] [ 2.71956e-10 -6.7532e-12 2.7564e-10 ] [ 4.08015e-10 1.26891e-10 4.08099e-10 ] [ 2.56948e-10 2.74723e-10 1.3466e-11 ] [ 4.07358e-10 4.092380000000001e-10 1.48906e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1419112 0.3361375 -0.2646483 ] [ -1.7067426 -0.519019 1.3941608 ] [ 1.1273507 -2.4025115 -0.4630245 ] [ 1.3601732 -0.3617794 0.4973157 ] [ -1.9697913 0.9679489 0.8658469 ] [ -0.0606551 2.1340487 1.189615 ] [ 1.6779328 0.1136882 -0.9509292 ] [ 0.7136434 -0.2685133 -2.2683365 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.829543427669673e-09 5.3855164387416e-10 -4.240133189944646e-10 ] [ -2.734503091443406e-09 -8.315601075509953e-10 2.233691839395825e-09 ] [ 1.806214934982515e-09 -3.849247756503139e-09 -7.418470287576096e-10 ] [ 2.179237701278722e-09 -5.796344965670515e-10 7.967875876967866e-10 ] [ -3.155953568715239e-09 1.550825097709077e-09 1.387239660372156e-09 ] [ -9.718018315228609e-11 3.419122934788633e-09 1.905973340752992e-09 ] [ 2.688344703433482e-09 1.821485761008346e-10 -1.523556532276048e-09 ] [ 1.143382771068223e-09 -4.302057316338567e-10 -3.634275708407299e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -217.14817 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.479097212235039e-17 } }