{ "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" [ 5.44038 0 0 ] "si-unit" "m" "si-value" [ 5.44038e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0177809 5.34742 0 ] "si-unit" "m" "si-value" [ 1.77809e-12 5.34742e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.258508 -0.216411 5.45927 ] "si-unit" "m" "si-value" [ 2.58508e-11 -2.16411e-11 5.459270000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0111666 -0.0485116 -0.0844937 ] [ 1.40892 1.32935 1.34318 ] [ 0.251238 2.67562 2.78628 ] [ 1.4893 4.10816 4.17197 ] [ 2.79244 -0.0558727 2.81547 ] [ 4.18247 1.3542 3.88471 ] [ 2.61313 2.71504 -0.144964 ] [ 4.08224 4.0407 1.29994 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.11666e-12 -4.851160000000001e-12 -8.44937e-12 ] [ 1.40892e-10 1.32935e-10 1.34318e-10 ] [ 2.51238e-11 2.67562e-10 2.78628e-10 ] [ 1.4893e-10 4.10816e-10 4.17197e-10 ] [ 2.79244e-10 -5.58727e-12 2.81547e-10 ] [ 4.182470000000001e-10 1.3542e-10 3.88471e-10 ] [ 2.61313e-10 2.71504e-10 -1.44964e-11 ] [ 4.08224e-10 4.0407e-10 1.29994e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.8688611 4.3966182 3.2891334 ] [ 0.3222733 -0.7191619 -0.2375012 ] [ -1.1935186 1.0017594 -1.0095751 ] [ 3.2259928 -4.2860709 -2.8647057 ] [ -0.0747619 0.7038426 -1.9888744 ] [ 1.3483962 -1.0037322 1.1968596 ] [ -0.0824335 1.135099 1.117076 ] [ 0.3229128 -1.2283543 0.4975874 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.198598803542571e-09 7.044158890623778e-09 5.269772636172414e-09 ] [ 5.163387467680646e-10 -1.152224382750108e-09 -3.80518870051945e-10 ] [ -1.912227597409947e-09 1.604995490346636e-09 -1.617517622161822e-09 ] [ 5.168610243029131e-09 -6.867042591071215e-09 -4.5897644980125e-09 ] [ -1.197817683065875e-10 1.127680158443086e-09 -3.186528065387628e-09 ] [ 2.160368867215561e-09 -1.60815626438415e-09 1.91758046950004e-09 ] [ -1.320730264707168e-10 1.818629080093459e-09 1.789753050856781e-09 ] [ 5.173633387170663e-10 -1.968040541519149e-09 7.972228990846579e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.0861 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.621412913505089e-18 } }