{ "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" [ 5.36644 0 0 ] "si-unit" "m" "si-value" [ 5.366440000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.227231 5.37948 0 ] "si-unit" "m" "si-value" [ -2.27231e-11 5.379480000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0350261 -0.0899265 5.39939 ] "si-unit" "m" "si-value" [ -3.50261e-12 -8.992650000000001e-12 5.399390000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00104229 0.0077963 0.00224549 ] [ 1.32493 1.37357 1.36608 ] [ -0.0958533 2.66355 2.80902 ] [ 1.19786 4.07015 4.22336 ] [ 2.70129 0.113781 2.60003 ] [ 3.9906 1.45175 3.98519 ] [ 2.48193 2.86985 0.00162227 ] [ 4.00824 4.16333 1.43322 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.04229e-13 7.7963e-13 2.24549e-13 ] [ 1.32493e-10 1.37357e-10 1.36608e-10 ] [ -9.58533e-12 2.66355e-10 2.80902e-10 ] [ 1.19786e-10 4.07015e-10 4.22336e-10 ] [ 2.70129e-10 1.13781e-11 2.60003e-10 ] [ 3.9906e-10 1.45175e-10 3.98519e-10 ] [ 2.48193e-10 2.86985e-10 1.62227e-13 ] [ 4.00824e-10 4.16333e-10 1.43322e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0964078 2.7411492 -0.9131032 ] [ -1.4739638 1.0476998 -0.4750243 ] [ 2.4359058 2.4314406 -2.3077188 ] [ -0.6042367 1.3790726 -3.8261098 ] [ 0.2050445 -1.7248985 2.0807499 ] [ -2.2079485 -2.0639729 3.3884897 ] [ 3.6826077 -1.7668587 1.6399724 ] [ -2.1338168 -2.0436322 0.412744 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.544623232227622e-10 4.391805162364623e-09 -1.462952599417667e-09 ] [ -2.361550340265527e-09 1.678600125176836e-09 -7.610728277718854e-10 ] [ 3.902751323231121e-09 3.895597284183925e-09 -3.697373108740631e-09 ] [ -9.680939141693432e-10 2.20951787810587e-09 -6.130103670173763e-09 ] [ 3.285175041236256e-10 -2.763592049952989e-09 3.333728843511938e-09 ] [ -3.537523466630429e-09 -3.306849126344777e-09 5.428958977161606e-09 ] [ 5.900187960518061e-09 -2.830819701397081e-09 2.627525438037266e-09 ] [ -3.41875139003027e-09 -3.274259732354069e-09 6.612887871754753e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.56607 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.698312584773627e-18 } }