{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.42631e-10 0.0 0.0 ] "source-value" [ 5.42631 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -4.19811e-12 5.40206e-10 0.0 ] "source-value" [ -0.0419811 5.40206 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -2.91495e-11 -1.84222e-11 5.7849e-10 ] "source-value" [ -0.291495 -0.184222 5.7849 ] } "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" [ [ -4.941125676177828e-09 -4.756280476606526e-09 -5.925693811232886e-09 ] [ 2.199301278448015e-09 2.530564272429044e-10 1.374150309967907e-08 ] [ -1.787240197044718e-09 -1.123034407004584e-08 -1.468823775644588e-08 ] [ -9.54128061001154e-10 1.333356698220368e-09 2.188613046058294e-08 ] [ 2.508887784055592e-09 8.265565099642369e-10 -2.021410582847554e-08 ] [ 7.121260115711212e-10 6.582478078838982e-09 1.479419354160328e-08 ] [ 3.364343715035171e-09 1.899899649401201e-09 -1.094976593346381e-08 ] [ -1.102164694668536e-09 5.091277343202329e-09 1.355976227752823e-09 ] ] "source-value" [ [ -3.0840081 -2.9686368 -3.6985272 ] [ 1.3726959 0.1579454 8.5767717 ] [ -1.1155076 -7.0094295 -9.167677 ] [ -0.5955199 0.8322158 13.6602483 ] [ 1.5659246 0.515896 -12.6166526 ] [ 0.4444741 4.1084597 9.2338094 ] [ 2.0998582 1.1858241 -6.8343064 ] [ -0.6879171 3.1777254 0.8463338 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.01951e-11 4.51697e-12 -1.78669e-11 ] [ 1.35762e-10 1.34832e-10 9.05447e-11 ] [ 4.53616e-11 2.71025e-10 3.0057e-10 ] [ 1.36179e-10 4.05856e-10 4.06079e-10 ] [ 2.63302e-10 -1.45655e-11 3.08939e-10 ] [ 4.07266e-10 1.35506e-10 3.53695e-10 ] [ 2.85903e-10 2.69843e-10 1.71649e-11 ] [ 4.20927e-10 3.69056e-10 1.74197e-10 ] ] "source-value" [ [ 0.101951 0.0451697 -0.178669 ] [ 1.35762 1.34832 0.905447 ] [ 0.453616 2.71025 3.0057 ] [ 1.36179 4.05856 4.06079 ] [ 2.63302 -0.145655 3.08939 ] [ 4.07266 1.35506 3.53695 ] [ 2.85903 2.69843 0.171649 ] [ 4.20927 3.69056 1.74197 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.956052214616571e-18 "source-value" -24.691736 } }