{ "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" [ 5.31945 0 0 ] "si-unit" "m" "si-value" [ 5.31945e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00383334 5.41695 0 ] "si-unit" "m" "si-value" [ -3.83334e-13 5.416950000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0189848 -0.118491 5.47074 ] "si-unit" "m" "si-value" [ 1.89848e-12 -1.18491e-11 5.47074e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0147515 -0.0960157 0.0381768 ] [ 1.54242 1.27348 1.38773 ] [ -0.0738039 2.51333 2.6891 ] [ 1.45374 4.04036 4.07661 ] [ 2.81495 -0.0309523 2.80877 ] [ 4.27456 1.30079 3.98727 ] [ 2.73206 2.74248 -0.103972 ] [ 3.9224 4.04214 1.39211 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.47515e-12 -9.60157e-12 3.81768e-12 ] [ 1.54242e-10 1.27348e-10 1.38773e-10 ] [ -7.38039e-12 2.51333e-10 2.6891e-10 ] [ 1.45374e-10 4.04036e-10 4.07661e-10 ] [ 2.81495e-10 -3.09523e-12 2.80877e-10 ] [ 4.27456e-10 1.30079e-10 3.98727e-10 ] [ 2.73206e-10 2.74248e-10 -1.03972e-11 ] [ 3.9224e-10 4.04214e-10 1.39211e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.4352008 1.4535904 -0.0528229 ] [ -1.6027471 0.4767337 -0.778974 ] [ 4.4757422 4.5476857 -4.4668839 ] [ -1.0673438 -0.9656789 0.2430509 ] [ -0.7255678 0.4788154 -0.1936112 ] [ -4.2603579 -3.6641593 5.3901563 ] [ 0.3557112 -1.008538 0.0685679 ] [ 1.3893624 -1.3184489 -0.2094831 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.299445167913457e-09 2.32890855509932e-09 -8.463161542285631e-11 ] [ -2.567883932674999e-09 7.638115884874809e-10 -1.248053931011059e-09 ] [ 7.170929513567958e-09 7.286195707286482e-09 -7.156736952407926e-09 ] [ -1.710073282715831e-09 -1.547188156779861e-09 3.894104696443987e-10 ] [ -1.16248776596529e-09 7.671468395590003e-10 -3.10199338165033e-10 ] [ -6.825845823620585e-09 -5.870630365346893e-09 8.635982406317832e-09 ] [ 5.699121683967129e-10 -1.61585600478839e-09 1.098578863173523e-10 ] [ 2.226003955098578e-09 -2.112388003299477e-09 -3.356289252727085e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -34.378827 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.508095286992781e-18 } }