{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.21631e-10 0.0 0.0 ] "source-value" [ 5.21631 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 3.40777e-11 5.491e-10 0.0 ] "source-value" [ 0.340777 5.491 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 7.644140000000001e-12 2.61433e-11 5.31631e-10 ] "source-value" [ 0.0764414 0.261433 5.31631 ] } "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" [ [ 7.110683266640172e-08 -9.784858127778103e-08 2.538987539773471e-08 ] [ 1.562384962245811e-09 -4.279886236042274e-09 1.898755535076288e-09 ] [ 3.04646258084405e-09 -7.010830092122573e-09 4.02293844222277e-09 ] [ 6.070893150322493e-09 6.779885945293977e-09 -3.602528098013161e-09 ] [ -7.096494310377535e-09 2.023057524283139e-09 6.876603580055839e-09 ] [ -6.081443467348695e-08 7.909399554553076e-08 -2.511343568336422e-08 ] [ -1.046225659259276e-08 1.248747929836125e-08 1.97665608607984e-09 ] [ -3.413387623139155e-09 8.754879452694412e-09 -1.144886525979207e-08 ] ] "source-value" [ [ 44.3813945 -61.0722813 15.8471139 ] [ 0.975164 -2.6712949 1.18511 ] [ 1.9014524 -4.375816 2.5109207 ] [ 3.7891535 4.231672 -2.2485212 ] [ -4.4292834 1.2626932 4.2920384 ] [ -37.9573849 49.3665895 -15.6745738 ] [ -6.530027 7.7940716 1.2337317 ] [ -2.130469 5.464366 -7.1458197 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -1.02562e-11 7.133879999999999e-12 -5.61849e-11 ] [ 1.48031e-10 1.58239e-10 7.79774e-11 ] [ 5.541660000000001e-11 2.97803e-10 2.26105e-10 ] [ 1.29704e-10 4.12978e-10 3.93608e-10 ] [ 3.06699e-10 -2.46774e-11 2.56051e-10 ] [ 4.28292e-10 1.50929e-10 4.5131e-10 ] [ 2.82838e-10 2.54855e-10 -6.98649e-11 ] [ 4.65405e-10 4.12903e-10 1.02077e-10 ] ] "source-value" [ [ -0.102562 0.0713388 -0.561849 ] [ 1.48031 1.58239 0.779774 ] [ 0.554166 2.97803 2.26105 ] [ 1.29704 4.12978 3.93608 ] [ 3.06699 -0.246774 2.56051 ] [ 4.28292 1.50929 4.5131 ] [ 2.82838 2.54855 -0.698649 ] [ 4.65405 4.12903 1.02077 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -8.826775526376194e-19 "source-value" -5.50924 } }