{ "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" [ 5.33408 0 0 ] "si-unit" "m" "si-value" [ 5.33408e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.034982 5.4373 0 ] "si-unit" "m" "si-value" [ 3.4982e-12 5.437299999999999e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.179208 0.185424 5.40079 ] "si-unit" "m" "si-value" [ 1.79208e-11 1.85424e-11 5.40079e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0492126 -0.0420999 -0.0477888 ] [ 1.41891 1.35069 1.31795 ] [ 0.0600152 2.70621 2.67075 ] [ 1.52388 3.98641 4.19062 ] [ 2.7955 -0.0317733 2.51171 ] [ 4.14719 1.34284 3.96242 ] [ 2.77343 2.76788 -0.181612 ] [ 4.04692 4.12597 1.21449 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.92126e-12 -4.209990000000001e-12 -4.77888e-12 ] [ 1.41891e-10 1.35069e-10 1.31795e-10 ] [ 6.00152e-12 2.70621e-10 2.67075e-10 ] [ 1.52388e-10 3.98641e-10 4.19062e-10 ] [ 2.7955e-10 -3.17733e-12 2.51171e-10 ] [ 4.14719e-10 1.34284e-10 3.96242e-10 ] [ 2.77343e-10 2.76788e-10 -1.81612e-11 ] [ 4.04692e-10 4.12597e-10 1.21449e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.3697483 0.4249019 -0.3542901 ] [ -0.276981 -0.2514263 -0.4432378 ] [ 1.4061847 0.9097282 -0.8295553 ] [ -2.2315647 3.1318714 -4.3606851 ] [ -1.4497966 0.1231757 2.8044385 ] [ -1.0862603 0.0512359 -0.5912815 ] [ 1.0010414 -2.5754765 2.9543071 ] [ 0.2676281 -1.8140104 0.8203041 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.796755323440545e-09 6.807678903134995e-10 -5.676353152008941e-10 ] [ -4.437724826058048e-10 -4.02829339714247e-10 -7.101452406148263e-10 ] [ 2.252956250866662e-09 1.457545253322466e-09 -1.32909410732073e-09 ] [ -3.575360790142565e-09 5.017811136432165e-09 -6.986587717890911e-09 ] [ -2.322830217435329e-09 1.973492267906746e-10 4.493205799171421e-09 ] [ -1.740380856763194e-09 8.208896112564672e-11 -9.473373956115553e-10 ] [ 1.603845127532901e-09 -4.126368235719812e-09 4.733321766283447e-09 ] [ 4.287874848891245e-10 -2.906365052768056e-09 1.314272050966385e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -40.793541 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.535845766984625e-18 } }