{ "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" [ [ 8.126319 4.8296031 -4.2188983 ] [ -0.4851715 -1.329425 6.2240855 ] [ 9.8744588 7.2127657 -10.7960373 ] [ -14.9350304 11.911174 -10.5032682 ] [ 0.1693689 1.449961 -2.0993023 ] [ -7.6567746 -5.688066 2.0752432 ] [ 10.1443419 -9.8929183 10.3108795 ] [ -5.2375122 -8.4930945 9.0072978 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.301979831496284e-08 7.737877174563204e-09 -6.759420221792866e-09 ] [ -7.773304343784672e-10 -2.12997365410704e-09 9.97208427396028e-09 ] [ 1.582062703241282e-08 1.155612457584815e-08 -1.729715855934476e-08 ] [ -2.392855653781727e-08 1.908380450908082e-08 -1.68280907520321e-08 ] [ 2.713588918706131e-10 2.323093615271789e-09 -3.363453065051668e-09 ] [ -1.226750525485527e-08 -9.113286362767374e-09 3.324906137514178e-09 ] [ 1.625302742558185e-08 -1.585020241174448e-08 1.651985007478599e-08 ] [ -8.391419597994774e-09 -1.360743744614506e-08 1.443128195174327e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -12.900465 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.066882342044867e-18 } }