{ "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" [ 5.05932 0 0 ] "si-unit" "m" "si-value" [ 5.059319999999999e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.224512 5.44129 0 ] "si-unit" "m" "si-value" [ 2.24512e-11 5.441290000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.327401 0.688972 5.24092 ] "si-unit" "m" "si-value" [ 3.27401e-11 6.88972e-11 5.24092e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.119472 0.0796179 0.152764 ] [ 1.48092 1.5486 0.772169 ] [ 0.0612704 2.84226 2.7863 ] [ 1.84412 4.4971 3.9905 ] [ 2.88701 0.305191 2.51679 ] [ 4.25223 1.88781 3.92663 ] [ 2.58737 2.78734 -0.624797 ] [ 3.988 4.24006 0.48768 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.19472e-11 7.96179e-12 1.52764e-11 ] [ 1.48092e-10 1.5486e-10 7.72169e-11 ] [ 6.127040000000001e-12 2.84226e-10 2.786300000000001e-10 ] [ 1.84412e-10 4.4971e-10 3.9905e-10 ] [ 2.88701e-10 3.05191e-11 2.51679e-10 ] [ 4.25223e-10 1.88781e-10 3.92663e-10 ] [ 2.58737e-10 2.78734e-10 -6.247970000000001e-11 ] [ 3.988e-10 4.24006e-10 4.8768e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 8.2247153 5.0097764 -3.2704916 ] [ -0.321176 -0.4992386 4.8411226 ] [ 8.8720409 7.8026583 -10.3402533 ] [ -15.0488885 12.0028456 -8.7664588 ] [ 0.3921469 0.7023914 -1.862151 ] [ -7.9411555 -6.9715893 3.9261196 ] [ 11.9858093 -10.2531793 8.6914988 ] [ -6.1634924 -7.7936644 6.7806138 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.317744656639606e-08 8.026546623515589e-09 -5.239905180042785e-09 ] [ -5.145806783620608e-10 -7.998684131209229e-10 7.75633344814651e-09 ] [ 1.421457650876139e-08 1.250123670835107e-08 -1.656691209041005e-08 ] [ -2.411097732372598e-08 1.923067860339215e-08 -1.404541533656642e-08 ] [ 6.282885950991956e-10 1.125355079730981e-09 -2.983494796599341e-09 ] [ -1.272313368423733e-08 -1.116971738627944e-08 6.290337033584648e-09 ] [ 1.920338344182721e-08 -1.642740416333051e-08 1.392531617707126e-08 ] [ -9.875003425758482e-09 -1.248682689204126e-08 1.086374090503385e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -12.826137 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.054973683657785e-18 } }