{ "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" [ 5.4726 0 0 ] "si-unit" "m" "si-value" [ 5.4726e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.038105 5.56078 0 ] "si-unit" "m" "si-value" [ 3.8105e-12 5.560780000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0300683 -0.0732695 5.55519 ] "si-unit" "m" "si-value" [ -3.00683e-12 -7.32695e-12 5.55519e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0119551 0.065874 -0.0174062 ] [ 1.35048 1.36142 1.35358 ] [ 0.0629681 2.82177 2.8468 ] [ 1.33242 4.00392 4.21267 ] [ 2.75302 -0.0155517 2.72 ] [ 4.0777 1.32793 4.00537 ] [ 2.56601 2.8685 0.00815077 ] [ 4.04738 3.99965 1.27482 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.19551e-12 6.587400000000001e-12 -1.74062e-12 ] [ 1.35048e-10 1.36142e-10 1.35358e-10 ] [ 6.296810000000001e-12 2.82177e-10 2.8468e-10 ] [ 1.33242e-10 4.00392e-10 4.21267e-10 ] [ 2.75302e-10 -1.55517e-12 2.72e-10 ] [ 4.0777e-10 1.32793e-10 4.00537e-10 ] [ 2.56601e-10 2.8685e-10 8.15077e-13 ] [ 4.047380000000001e-10 3.99965e-10 1.27482e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.2316085 -0.0189638 0.0842211 ] [ -0.0839293 -0.5089203 0.6096651 ] [ -0.8617435 -0.0395736 -0.9458953 ] [ 0.3174395 2.2905991 -0.8105219 ] [ -0.2829205 -0.9217795 0.1054964 ] [ -0.1786812 0.1862367 0.8812011 ] [ 1.1501537 -1.5417765 -0.1318994 ] [ 1.1712898 0.5541778 0.2077329 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.973254344678557e-09 -3.038335700152704e-11 1.349370773980589e-10 ] [ -1.344695622601094e-10 -8.153802065105222e-10 9.767911697376941e-10 ] [ -1.380665288826365e-09 -6.340389672089089e-11 -1.515491335384602e-09 ] [ 5.085941454184416e-10 3.669944325645521e-09 -1.298599238826396e-09 ] [ -4.532886106450464e-10 -1.476853564432714e-09 1.690238656585651e-10 ] [ -2.86278841216489e-10 2.983840866749433e-10 1.411839800643243e-09 ] [ 1.842749368466617e-09 -2.470198262798851e-09 -2.113261349775475e-10 ] [ 1.876613133741508e-09 8.878907149263783e-10 3.328247957509843e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 141.91915 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.273795441738083e-17 } }