{ "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" [ 5.46847 0 0 ] "si-unit" "m" "si-value" [ 5.46847e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0752926 5.44594 0 ] "si-unit" "m" "si-value" [ 7.52926e-12 5.44594e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.00412544 0.201844 5.40303 ] "si-unit" "m" "si-value" [ 4.12544e-13 2.01844e-11 5.40303e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00347607 -0.00350605 -0.096896 ] [ 1.33363 1.43287 1.45525 ] [ -0.0378093 2.6958 2.61111 ] [ 1.37012 4.12622 4.01894 ] [ 2.67267 0.0858706 2.76525 ] [ 3.9434 1.3374 3.96298 ] [ 2.74102 2.68949 -0.0467586 ] [ 4.13757 3.9786 1.32692 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.47607e-13 -3.50605e-13 -9.6896e-12 ] [ 1.33363e-10 1.43287e-10 1.45525e-10 ] [ -3.78093e-12 2.6958e-10 2.61111e-10 ] [ 1.37012e-10 4.12622e-10 4.01894e-10 ] [ 2.67267e-10 8.58706e-12 2.76525e-10 ] [ 3.9434e-10 1.3374e-10 3.96298e-10 ] [ 2.74102e-10 2.68949e-10 -4.67586e-12 ] [ 4.137570000000001e-10 3.9786e-10 1.32692e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.20127249999999997 -0.49735769999999996 1.0889610999999997 ] [ 0.5995524999999999 -1.1203119999999998 -2.0706542999999997 ] [ -0.29965359999999996 0.46710869999999993 1.9562833999999998 ] [ -0.6375005999999999 0.24993459999999998 -0.37853839999999994 ] [ -0.6420724999999999 -2.0616375999999996 -1.7364576999999999 ] [ 1.7560658999999998 1.9789639999999997 1.2971190999999997 ] [ 0.05097639999999999 -0.8545818999999999 0.46744319999999995 ] [ -0.6260954999999999 1.8378818999999997 -0.6241563999999998 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.224740939099679e-10 -7.968548791148601e-10 1.74470801538065e-09 ] [ 9.605889984421918e-10 -1.794937694401689e-09 -3.317553909218989e-09 ] [ -4.800979922585549e-10 7.483906385122809e-10 3.134311527139135e-09 ] [ -1.021388557065972e-09 4.004393728489997e-10 -6.064853745550387e-10 ] [ -1.028713548358608e-09 -3.303107563282222e-09 -2.78211192994814e-09 ] [ 2.81352772956411e-09 3.170649854204851e-09 2.078213896413137e-09 ] [ 8.167319629254911e-11 -1.369191140738843e-09 7.489265665919385e-10 ] [ -1.003115572488086e-09 2.944611411971483e-09 -1.000008791802693e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.17744424065424 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.752129956747183e-18 } }