{ "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" [ [ -1.2679503 -1.4139278 -1.0751584 ] [ 0.2208954 0.8849859 0.9321244 ] [ -2.1549456 -2.6479326 -2.4874192 ] [ -0.3946397 3.8598604 0.0006385 ] [ -0.3196382 -1.0372793 -1.1834686 ] [ 1.38956 0.1509626 1.311409 ] [ 1.165227 -2.7634 0.7316191 ] [ 1.3614914 2.9667309 1.7702552 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.031480326996346e-09 -2.265362064659178e-09 -1.722593652136735e-09 ] [ 3.539134455222643e-10 1.417903718717647e-09 1.493427921357228e-09 ] [ -3.452603459415828e-09 -4.242455705174158e-09 -3.985284888369039e-09 ] [ -6.322825009795258e-10 6.184178092431736e-09 1.0229897723808e-12 ] [ -5.121168511545945e-10 -1.661904643699789e-09 -1.896125722370907e-09 ] [ 2.226320545198848e-09 2.418687483351821e-10 2.101108840106707e-09 ] [ 1.866899457324921e-09 -4.42745487391872e-09 1.172183017350737e-09 ] [ 2.181349690500261e-09 4.753226888184943e-09 2.836261494289628e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.364822 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.82628676279535e-18 } }