{ "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" [ 5.43079 0 0 ] "si-unit" "m" "si-value" [ 5.43079e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0839771 5.43297 0 ] "si-unit" "m" "si-value" [ -8.397710000000001e-12 5.432970000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0398452 0.0785902 5.46584 ] "si-unit" "m" "si-value" [ 3.98452e-12 7.85902e-12 5.46584e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0520054 -0.0817533 0.0407426 ] [ 1.35344 1.3045 1.28849 ] [ 0.00819716 2.75378 2.6961 ] [ 1.33497 4.09637 3.90076 ] [ 2.57675 -0.0301907 2.72622 ] [ 4.09447 1.46101 4.06258 ] [ 2.65601 2.62697 -0.116016 ] [ 4.03834 4.01266 1.20961 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.20054e-12 -8.17533e-12 4.07426e-12 ] [ 1.35344e-10 1.3045e-10 1.28849e-10 ] [ 8.197160000000001e-13 2.75378e-10 2.6961e-10 ] [ 1.33497e-10 4.09637e-10 3.90076e-10 ] [ 2.57675e-10 -3.01907e-12 2.72622e-10 ] [ 4.09447e-10 1.46101e-10 4.06258e-10 ] [ 2.656010000000001e-10 2.62697e-10 -1.16016e-11 ] [ 4.03834e-10 4.012660000000001e-10 1.20961e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 4.9103305 3.7907737 -7.6532474 ] [ -1.8403074 0.8516549 1.3682266 ] [ -0.9470237 -1.3983876 -4.1353833 ] [ -6.4050832 -5.5860895 12.3224507 ] [ 11.6321094 7.1641511 -7.8357684 ] [ -0.400488 -4.7077795 -0.6902739 ] [ -1.2734374 3.027497 -0.2209176 ] [ -5.6761003 -3.1418201 6.8449133 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.867216792317535e-09 6.073489046921726e-09 -1.226185415850125e-08 ] [ -2.948497515657291e-09 1.364501581011607e-09 2.192140688537264e-09 ] [ -1.517299243984225e-09 -2.240463937995338e-09 -6.625614495893811e-09 ] [ -1.026207464186595e-08 -8.949902072332742e-09 1.974274258515694e-08 ] [ 1.863669388481176e-08 1.14782354948654e-08 -1.255428503991557e-08 ] [ -6.41652515797392e-10 -7.542694312924203e-09 -1.105940713640052e-09 ] [ -2.040271647141711e-09 4.850584952905098e-09 -3.539490167593584e-10 ] [ -9.094115272900389e-09 -5.033750752451542e-09 1.096676015101583e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -33.873388 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.427115076801599e-18 } }