{ "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" [ 5.43182 0 0 ] "si-unit" "m" "si-value" [ 5.43182e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00436542 5.42411 0 ] "si-unit" "m" "si-value" [ -4.36542e-13 5.42411e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.250705 -0.013062 5.36378 ] "si-unit" "m" "si-value" [ 2.50705e-11 -1.3062e-12 5.36378e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00336868 -0.0347308 0.0739509 ] [ 1.33721 1.36002 1.29514 ] [ 0.0804819 2.71297 2.74807 ] [ 1.4297 4.00589 4.14244 ] [ 2.76212 -0.0429027 2.66501 ] [ 4.31635 1.33651 3.99144 ] [ 2.62716 2.67896 0.144482 ] [ 3.97118 3.97277 1.25678 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.36868e-13 -3.47308e-12 7.395090000000001e-12 ] [ 1.33721e-10 1.36002e-10 1.29514e-10 ] [ 8.04819e-12 2.71297e-10 2.74807e-10 ] [ 1.4297e-10 4.00589e-10 4.14244e-10 ] [ 2.76212e-10 -4.29027e-12 2.66501e-10 ] [ 4.31635e-10 1.33651e-10 3.99144e-10 ] [ 2.62716e-10 2.67896e-10 1.44482e-11 ] [ 3.97118e-10 3.97277e-10 1.25678e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.7874911 0.7821522 -0.3920332 ] [ -0.3719245 -1.4041269 2.4686926 ] [ 0.133323 1.0062869 -1.6646299 ] [ 1.6581502 -0.4703202 -1.1743184 ] [ -0.1122569 0.5159001 0.5893874 ] [ -2.0261227 -1.3809672 1.6333102 ] [ 0.2453787 -0.2370229 -3.8889532 ] [ 2.2609434 1.1880978 2.4285445 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.863876450308075e-09 1.253145968747286e-09 -6.281064276174106e-10 ] [ -5.958887386027297e-10 -2.24965929181638e-09 3.955281567661966e-09 ] [ 2.136069936149184e-10 1.612249344997308e-09 -2.667031108064642e-09 ] [ 2.656649484214844e-09 -7.535360287299802e-10 -1.881465485855263e-09 ] [ -1.798553807034835e-10 8.26563078888382e-10 9.44302712874098e-10 ] [ -3.246206420812173e-09 -2.212553361931638e-09 2.616851416954172e-09 ] [ 3.931400163822969e-10 -3.797525489742164e-10 -6.230789896425347e-09 ] [ 3.622430656432063e-09 1.903542518383914e-09 3.890957220472426e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.942114 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.758561475292837e-18 } }