{ "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" [ [ 3.2653649 2.9715018 0.6692174 ] [ -9.0015292 -5.4566401 4.3442759 ] [ 1.0198971 -0.4534665 -0.9644462 ] [ 1.8794883 -1.5817971 0.3968126 ] [ 4.6832127 -0.7707593 0.2438777 ] [ -2.9167861 -0.2872594 -1.2511514 ] [ 4.4618498 6.0094582 -7.4391087 ] [ -3.3914977 -0.4310376 4.0005226 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.231691344263745e-09 4.760870751848941e-09 1.072204481346231e-09 ] [ -1.442203975450871e-08 -8.742501268367423e-09 6.960297338629321e-09 ] [ 1.634055302704361e-09 -7.265334306017609e-10 -1.545213166390091e-09 ] [ 3.011272238136382e-09 -2.534318353348961e-09 6.357638757967883e-10 ] [ 7.503333959992051e-09 -1.234892540898196e-09 3.907351524936618e-10 ] [ -4.673206535795987e-09 -4.602402985768595e-10 -2.004565538676387e-09 ] [ 7.148671493977573e-09 9.628213511039699e-09 -1.191876613692611e-08 ] [ -5.43377836920474e-09 -6.905983710954383e-10 6.409543833508928e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.703267 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.560076351086327e-18 } }