{ "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" [ [ -5.433873493728247e-09 -5.743339675871603e-09 -4.228147306644441e-09 ] [ 2.336230822691701e-09 2.907287265630989e-10 1.125060038906261e-08 ] [ -6.571342951324422e-09 -1.301555062430577e-08 -1.24936148337306e-08 ] [ -1.313597053956042e-09 2.84448050013667e-09 2.115201345336771e-08 ] [ 5.062574028605372e-09 4.727648138433871e-09 -1.490333221083555e-08 ] [ 2.83405786056538e-09 3.198438486168992e-09 7.965869791620961e-09 ] [ 3.339404714408785e-09 2.445468506439141e-09 -6.811849368878938e-09 ] [ -2.534539272625248e-10 5.2521259424356e-09 -1.931540074179408e-09 ] ] "source-value" [ [ -3.3915571 -3.5847107 -2.639002 ] [ 1.4581606 0.1814586 7.0220725 ] [ -4.1015097 -8.1236678 -7.7979011 ] [ -0.8198828 1.7753851 13.2020485 ] [ 3.1598102 2.9507659 -9.3019284 ] [ 1.7688798 1.9963083 4.9719049 ] [ 2.0842925 1.5263414 -4.251622 ] [ -0.1581935 3.2781192 -1.2055725 ] ] } "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" -4.211226398916849e-18 "source-value" -26.284408 } }