{ "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" [ [ 0.3993905 0.0844703 0.4149375 ] [ -1.4258538 0.25986 1.0462157 ] [ 1.0030154 -1.99755 0.1823554 ] [ -0.2495913 0.3267784 0.1474017 ] [ -0.655396 0.4577766 0.4463234 ] [ -0.3575133 0.8832783 0.8705629 ] [ 1.6882119 0.1452435 -1.3187991 ] [ -0.4022633 -0.1598571 -1.7889975 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.398941216696224e-10 1.353363398119623e-10 6.648031615931999e-10 ] [ -2.284469623038839e-09 4.16341616681088e-10 1.676222334853907e-09 ] [ 1.60700782418236e-09 -3.20042790887904e-09 2.921655585566323e-10 ] [ -3.99889345615079e-10 5.235567126624308e-10 2.361635576061754e-10 ] [ -1.050060148565837e-09 7.334389660693133e-10 7.150889167959667e-10 ] [ -5.727994508850566e-10 1.415167841919969e-09 1.394795525315849e-09 ] [ 2.704813637136348e-09 2.327057400231648e-10 -2.112949085552081e-09 ] [ -6.444968546658566e-10 -2.561193082888877e-10 -2.866289969169648e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.34499924065424 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.778975227116998e-18 } }