{ "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" [ [ -1.3909423 -1.4670066 -0.5169729 ] [ 0.0073076 0.7042316 0.9268719 ] [ -1.4702601 -1.7495858 -2.0430497 ] [ 0.5199394 3.5441806 -0.8255067 ] [ -1.0366956 -1.8446121 -0.1895376 ] [ -0.1164202 1.2831313 2.3068452 ] [ 1.9609939 -2.9917152 -0.8507942 ] [ 1.5260773 2.5213763 1.192144 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.228535252302218e-09 -2.350403696443784e-09 -8.282819007912185e-10 ] [ 1.17080659706184e-11 1.128303414444434e-09 1.485012500891184e-09 ] [ -2.355616378122503e-09 -2.803145487938197e-09 -3.27332649144071e-09 ] [ 8.330347577759796e-10 5.6784033439961e-09 -1.322607545950448e-09 ] [ -1.66096946689061e-09 -2.955394405413671e-09 -3.036727139844384e-10 ] [ -1.865257241656068e-10 2.055802987214044e-09 3.695973477695056e-09 ] [ 3.141858605996532e-09 -4.793256189022636e-09 -1.363122587582723e-09 ] [ 2.445045391737808e-09 4.039690193381374e-09 1.910025261163296e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.011392292303476 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.449225802053633e-18 } }