{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.42446e-10 0.0 0.0 ] "source-value" [ 5.42446 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -2.25581e-13 5.46076e-10 0.0 ] "source-value" [ -0.00225581 5.46076 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.17255e-12 3.43157e-12 5.56103e-10 ] "source-value" [ -0.0117255 0.0343157 5.56103 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.482872621561735e-09 -2.378053079895091e-10 5.438269706158062e-10 ] [ -2.313107248394342e-10 1.352250526238815e-09 -2.107825484936425e-09 ] [ -1.604892149954594e-09 1.583934237795571e-10 2.955012902811379e-10 ] [ 2.795846909465273e-09 1.019073411848917e-09 1.375997347241664e-11 ] [ 2.133937439066899e-10 -2.560434772694253e-09 1.52820845209454e-09 ] [ 3.830176247097447e-10 9.118603986971808e-10 9.244022372848033e-10 ] [ -1.0555863761663e-09 -7.847871245893326e-10 -1.020026867155954e-09 ] [ 9.824035944403565e-10 1.414492844909626e-10 -1.778465716563245e-10 ] ] "source-value" [ [ -0.9255363 -0.1484264 0.3394301 ] [ -0.1443728 0.8440084 -1.3156012 ] [ -1.0016949 0.0988614 0.1844374 ] [ 1.7450304 0.6360556 0.0085883 ] [ 0.1331899 -1.5980977 0.9538327 ] [ 0.2390608 0.5691385 0.5769665 ] [ -0.6588452 -0.4898256 -0.6366507 ] [ 0.6131681 0.0882857 -0.1110031 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.82071e-12 1.39191e-13 1.64222e-12 ] [ 1.32892e-10 1.32964e-10 1.49498e-10 ] [ -5.098020000000001e-13 2.67752e-10 2.7579e-10 ] [ 1.15566e-10 4.0451e-10 4.18086e-10 ] [ 2.64397e-10 1.06198e-11 2.73506e-10 ] [ 4.036990000000001e-10 1.34406e-10 4.11378e-10 ] [ 2.695e-10 2.72586e-10 1.09097e-11 ] [ 4.009330000000001e-10 4.13019e-10 1.43696e-10 ] ] "source-value" [ [ 0.0182071 0.00139191 0.0164222 ] [ 1.32892 1.32964 1.49498 ] [ -0.00509802 2.67752 2.7579 ] [ 1.15566 4.0451 4.18086 ] [ 2.64397 0.106198 2.73506 ] [ 4.03699 1.34406 4.11378 ] [ 2.695 2.72586 0.109097 ] [ 4.00933 4.13019 1.43696 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.925794908577658e-18 "source-value" -36.985903 } }