{ "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" [ [ 0.4196194 0.4937463 0.355585 ] [ -0.8185116 -0.405079 0.247015 ] [ -0.1059426 -0.1482776 -0.0599278 ] [ 0.5044587 -0.284079 0.0705311 ] [ 0.4480498 -0.3456715 0.1412918 ] [ -0.3130056 -0.1141593 -0.51924 ] [ 0.3216304 0.4741938 -0.776543 ] [ -0.4562983 0.3293262 0.5412879 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.723043923141235e-10 7.910687784665031e-10 5.69709973707168e-10 ] [ -1.311400149373601e-09 -6.490081033770434e-10 3.95761657986912e-10 ] [ -1.697387568667661e-10 -2.375669041083341e-10 -9.601492009597825e-11 ] [ 8.082319352991611e-10 -4.551447322602432e-10 1.130032794593069e-10 ] [ 7.178549145141159e-10 -5.538267957768673e-10 2.263744186707494e-10 ] [ -5.014902544994765e-10 -1.829033615068934e-10 -8.31914188584192e-10 ] [ 5.153087074185523e-10 7.59742220088311e-10 -1.244159039645895e-09 ] [ -7.310704683707846e-10 5.27638738256905e-10 8.672388185019285e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 153.43633 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.458321007073537e-17 } }