{ "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" [ 5.46438 0 0 ] "si-unit" "m" "si-value" [ 5.46438e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0372754 5.43203 0 ] "si-unit" "m" "si-value" [ 3.72754e-12 5.432030000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.17857 -0.0223871 5.50346 ] "si-unit" "m" "si-value" [ 1.7857e-11 -2.23871e-12 5.503459999999999e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00726127 0.010583 0.00336114 ] [ 1.28417 1.2786 1.26313 ] [ 0.0794421 2.71348 2.73185 ] [ 1.57701 4.05847 4.12903 ] [ 2.78941 -0.159624 2.68623 ] [ 4.22148 1.3448 3.91745 ] [ 2.73822 2.68922 0.00939316 ] [ 4.14349 4.04668 1.21083 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.26127e-13 1.0583e-12 3.36114e-13 ] [ 1.28417e-10 1.2786e-10 1.26313e-10 ] [ 7.944210000000001e-12 2.71348e-10 2.73185e-10 ] [ 1.57701e-10 4.05847e-10 4.12903e-10 ] [ 2.78941e-10 -1.59624e-11 2.68623e-10 ] [ 4.22148e-10 1.3448e-10 3.91745e-10 ] [ 2.73822e-10 2.68922e-10 9.39316e-13 ] [ 4.14349e-10 4.04668e-10 1.21083e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.2630819 -1.3959404 -3.5688885 ] [ 3.32136 2.1904017 2.8572828 ] [ 1.5509485 1.7980128 -1.8381146 ] [ -1.7148313 -1.482178 0.5225496 ] [ 0.5203336 2.6497707 -1.1399475 ] [ -1.6217721 -2.1055221 2.9253406 ] [ -0.5462527 -1.1249465 -1.4272832 ] [ 0.7532959 -0.5295982 1.6690608 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.625856911135644e-09 -2.2365430729102e-09 -5.71798971694198e-09 ] [ 5.321405341260288e-09 3.509410393900575e-09 4.577871701173963e-09 ] [ 2.484893426764829e-09 2.880734072059146e-09 -2.944984238471144e-09 ] [ -2.747462617476071e-09 -2.374710939464103e-09 8.372167523283917e-10 ] [ 8.336663289366988e-10 4.24540066602085e-09 -1.826397233439408e-09 ] [ -2.59836534288572e-09 -3.37341828319772e-09 4.686912317197045e-09 ] [ -8.751933049888763e-10 -1.802362981950787e-09 -2.286759774300611e-09 ] [ 1.206913079524495e-09 -8.485098544577626e-10 2.674130192453744e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.885689 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.749521193709974e-18 } }