{ "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" [ 5.40836 0 0 ] "si-unit" "m" "si-value" [ 5.40836e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0676972 5.56169 0 ] "si-unit" "m" "si-value" [ 6.76972e-12 5.561689999999999e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0290382 0.0456166 5.46301 ] "si-unit" "m" "si-value" [ 2.90382e-12 4.56166e-12 5.46301e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.160852 -0.0174641 0.0414383 ] [ 1.3693 1.3835 1.35672 ] [ 0.168786 2.76991 2.61562 ] [ 1.32577 4.00891 4.07743 ] [ 2.71647 0.0672876 2.67609 ] [ 4.01486 1.47906 4.19059 ] [ 2.74225 2.69331 -0.0428987 ] [ 4.04746 4.06755 1.1226 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.60852e-11 -1.74641e-12 4.14383e-12 ] [ 1.3693e-10 1.3835e-10 1.35672e-10 ] [ 1.68786e-11 2.76991e-10 2.61562e-10 ] [ 1.32577e-10 4.008910000000001e-10 4.07743e-10 ] [ 2.71647e-10 6.728760000000001e-12 2.67609e-10 ] [ 4.01486e-10 1.47906e-10 4.19059e-10 ] [ 2.74225e-10 2.69331e-10 -4.28987e-12 ] [ 4.04746e-10 4.06755e-10 1.1226e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.3711234 -0.554517 -1.4890279 ] [ 1.0546198 -0.3371804 -0.4948068 ] [ -3.219616 0.0889548 0.4434264 ] [ 1.8442348 2.1964743 0.0974198 ] [ 0.50429 -1.5449422 0.7237468 ] [ 2.4117967 -2.2155556 -2.4438548 ] [ -1.7377912 0.5868183 0.2949558 ] [ 1.5135893 1.7799477 2.8681408 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.798958476511807e-09 -8.884341732361537e-10 -2.38568568909892e-09 ] [ 1.689687187392772e-09 -5.402225538719923e-10 -7.927678867728614e-10 ] [ -5.158393483153613e-09 1.425213008679399e-10 7.104474111255092e-10 ] [ 2.954789879825764e-09 3.519139771648046e-09 1.560837259630119e-10 ] [ 8.07961648103232e-10 -2.475270273327318e-09 1.159570202338813e-09 ] [ 3.864124286862592e-09 -3.549711384402517e-09 -3.91548702518986e-09 ] [ -2.784248432471977e-09 9.401865609176006e-10 4.725712869293606e-10 ] [ 2.425037389953038e-09 2.851790591186732e-09 4.595268134922609e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.371042 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.667065654573488e-18 } }