{ "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" [ 5.37157 0 0 ] "si-unit" "m" "si-value" [ 5.37157e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00742946 5.44743 0 ] "si-unit" "m" "si-value" [ -7.42946e-13 5.447429999999999e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0324182 0.1292 5.41398 ] "si-unit" "m" "si-value" [ 3.24182e-12 1.292e-11 5.41398e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0294164 -0.0853048 -0.0527531 ] [ 1.50657 1.46533 1.29324 ] [ 0.0376731 2.77305 2.66982 ] [ 1.30492 4.09759 4.08062 ] [ 2.57907 0.017247 2.67471 ] [ 4.14556 1.36588 4.04305 ] [ 2.78643 2.5664 0.0569683 ] [ 4.11497 4.06206 1.21769 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.94164e-12 -8.530480000000001e-12 -5.27531e-12 ] [ 1.50657e-10 1.46533e-10 1.29324e-10 ] [ 3.76731e-12 2.77305e-10 2.66982e-10 ] [ 1.30492e-10 4.09759e-10 4.08062e-10 ] [ 2.57907e-10 1.7247e-12 2.67471e-10 ] [ 4.14556e-10 1.36588e-10 4.04305e-10 ] [ 2.78643e-10 2.5664e-10 5.69683e-12 ] [ 4.114969999999999e-10 4.06206e-10 1.21769e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.2048133 2.1880675 0.0300014 ] [ -10.2175497 -6.9020601 7.5842331 ] [ 0.4026151 -0.5248568 -0.5919717 ] [ 1.2003566 -1.0252963 -0.1102793 ] [ 1.7047363 -0.5546529 0.7025978 ] [ -1.4832437 0.6882008 -0.7261793 ] [ 8.1304657 7.6341498 -9.1234539 ] [ -1.9421936 -1.503552 2.2350519 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.532500322488897e-09 3.505670593232304e-09 4.806754167126912e-11 ] [ -1.637031925120205e-08 -1.105831932757651e-08 1.215128095951751e-08 ] [ 6.450605004010542e-10 -8.409132942279015e-10 -9.484432179152314e-10 ] [ 1.923183281142978e-09 -1.642705761252743e-09 -1.766869162181895e-10 ] [ 2.731288644489095e-09 -8.886519090389204e-10 1.125685768985514e-09 ] [ -2.376418379088889e-09 1.102619232175857e-09 -1.163467496968909e-09 ] [ 1.302644206075631e-08 1.2231256329245e-08 -1.461738453952658e-08 ] [ -3.111737178987387e-09 -2.408955862557082e-09 3.58094790045462e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -62.742327 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.005242894539886e-17 } }