{ "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" [ 5.51526 0 0 ] "si-unit" "m" "si-value" [ 5.51526e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0933018 5.35906 0 ] "si-unit" "m" "si-value" [ -9.33018e-12 5.35906e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.235006 -0.443739 5.60819 ] "si-unit" "m" "si-value" [ 2.35006e-11 -4.43739e-11 5.60819e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0139599 -0.0171452 -0.258284 ] [ 1.4668 1.50235 1.27166 ] [ -0.150248 2.65293 3.01531 ] [ 1.35939 3.8116 4.44507 ] [ 2.6266 -0.11212 2.88055 ] [ 3.83653 1.13315 3.7283 ] [ 2.72617 2.6833 0.230289 ] [ 3.93014 4.1583 1.51189 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.39599e-12 -1.71452e-12 -2.58284e-11 ] [ 1.4668e-10 1.50235e-10 1.27166e-10 ] [ -1.50248e-11 2.65293e-10 3.01531e-10 ] [ 1.35939e-10 3.8116e-10 4.44507e-10 ] [ 2.6266e-10 -1.1212e-11 2.88055e-10 ] [ 3.83653e-10 1.13315e-10 3.7283e-10 ] [ 2.72617e-10 2.6833e-10 2.30289e-11 ] [ 3.930140000000001e-10 4.1583e-10 1.51189e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -39.2230242 37.5936397 32.4877585 ] [ -18.9388906 -18.9080473 15.9530609 ] [ 4.3861843 3.6365891 -6.5598833 ] [ 40.5715944 -35.379131 -30.6098732 ] [ -28.785008 -23.0782555 -18.2273379 ] [ 22.8085517 22.5300681 27.4657044 ] [ 13.5275336 15.348001 -19.1993514 ] [ 5.6530588 -1.7428641 -1.310078 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.284221288805653e-08 6.023165111435475e-08 5.205112755973487e-08 ] [ -3.034344799320224e-08 -3.029403157862678e-08 2.555962141475901e-08 ] [ 7.027441997877646e-09 5.826458083479089e-09 -1.051009174502681e-08 ] [ 6.500286055180525e-08 -5.668361701942505e-08 -4.90424236107428e-08 ] [ -4.611866722710307e-08 -3.697544171558199e-08 -2.920341488340262e-08 ] [ 3.654332858912097e-08 3.609714867224877e-08 4.400490982603098e-08 ] [ 2.16734982495699e-08 2.459020858080863e-08 -3.076075220103518e-08 ] [ 9.057198719988078e-09 -2.792376137257439e-09 -2.098976360317452e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.399706 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.82643425876696e-18 } }