{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.47225e-10 0.0 0.0 ] "source-value" [ 5.47225 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -7.20088e-12 5.55574e-10 0.0 ] "source-value" [ -0.0720088 5.55574 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -6.10026e-12 -2.68755e-12 5.37267e-10 ] "source-value" [ -0.0610026 -0.0268755 5.37267 ] } "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" [ [ 1.34511891766431e-09 5.326948872368256e-10 -2.370299666574054e-09 ] [ 2.004555748883802e-09 -9.1142204317373e-10 -1.560561845469003e-09 ] [ -6.892975582073145e-10 -4.988729387717376e-11 2.847553474895364e-09 ] [ -3.855154180615719e-10 1.569094557498397e-09 -9.330387703592257e-11 ] [ -4.313140853765937e-09 -7.201937078580948e-09 -5.836464589778982e-09 ] [ 4.999043559931439e-09 6.562364834194445e-09 5.478326845378316e-09 ] [ 9.991867149785606e-10 -7.859374874030668e-10 2.576248736594534e-10 ] [ -3.959951111423288e-09 2.850296241052512e-10 1.277124784924827e-09 ] ] "source-value" [ [ 0.8395572000000002 0.33248200000000006 -1.4794247000000003 ] [ 1.2511453000000001 -0.5688649000000001 -0.9740261000000002 ] [ -0.4302257000000001 -0.031137200000000007 1.7773031000000004 ] [ -0.24061980000000005 0.9793518000000002 -0.058235700000000015 ] [ -2.6920508000000005 -4.495095600000001 -3.6428347000000008 ] [ 3.120157600000001 4.095906000000001 3.4193027000000007 ] [ 0.6236433000000001 -0.49054360000000014 0.16079680000000002 ] [ -2.4716071000000004 0.17790150000000002 0.7971186000000002 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.05094e-12 -7.580470000000001e-12 1.42316e-11 ] [ 1.30951e-10 1.38319e-10 1.48801e-10 ] [ -6.02099e-12 2.69484e-10 2.70363e-10 ] [ 1.30902e-10 4.05591e-10 4.11478e-10 ] [ 2.76224e-10 8.53385e-12 2.86654e-10 ] [ 4.01949e-10 1.17816e-10 4.04456e-10 ] [ 2.72232e-10 2.71295e-10 6.983420000000001e-12 ] [ 4.15368e-10 4.127030000000001e-10 1.42088e-10 ] ] "source-value" [ [ 0.0205094 -0.0758047 0.142316 ] [ 1.30951 1.38319 1.48801 ] [ -0.0602099 2.69484 2.70363 ] [ 1.30902 4.05591 4.11478 ] [ 2.76224 0.0853385 2.86654 ] [ 4.01949 1.17816 4.04456 ] [ 2.72232 2.71295 0.0698342 ] [ 4.15368 4.12703 1.42088 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.343368138595877e-18 "source-value" -33.350681 } }