{ "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" [ [ 0.3996775 0.0534358 0.3742669 ] [ -1.7035764 0.271917 1.2291007 ] [ 1.1698344 -2.4303457 0.1432357 ] [ -0.2300576 0.4780466 0.1936211 ] [ -0.8009015 0.5233197 0.5622381 ] [ -0.4414551 1.1119279 1.0226931 ] [ 2.0077482 0.1393865 -1.4483215 ] [ -0.4012695 -0.1476877 -2.0768341 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.403539463597921e-10 8.561358947374464e-11 5.996416771192916e-10 ] [ -2.729430279826629e-09 4.356590601980736e-10 1.969236406148915e-09 ] [ 1.874281325887596e-09 -3.893843061001811e-09 2.294888898039225e-10 ] [ -3.68592908157358e-10 7.659150861729293e-10 3.102151997135788e-10 ] [ -1.283185658863651e-09 8.384505885440699e-10 9.008047391430125e-10 ] [ -7.072890403529261e-10 1.78150488539524e-09 1.638534975073476e-09 ] [ 3.216767226493282e-09 2.233217915551392e-10 -2.320466846701988e-09 ] [ -6.429046115401056e-10 -2.366217801197242e-10 -3.32745504030021e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.017336 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.770613368269819e-18 } }