{ "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" [ 5.56756 0 0 ] "si-unit" "m" "si-value" [ 5.56756e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.603325 5.38792 0 ] "si-unit" "m" "si-value" [ 6.033250000000001e-11 5.387920000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.402741 -0.450618 5.48706 ] "si-unit" "m" "si-value" [ -4.02741e-11 -4.50618e-11 5.48706e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.336492 0.0638405 0.189929 ] [ 1.53887 1.35333 1.11771 ] [ 0.318438 2.15889 3.01891 ] [ 1.68585 3.81794 4.45016 ] [ 2.72641 -0.320403 2.65546 ] [ 4.33601 0.74819 4.56114 ] [ 3.14234 2.88247 0.0769818 ] [ 4.12798 3.93896 1.35009 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.36492e-11 6.38405e-12 1.89929e-11 ] [ 1.53887e-10 1.35333e-10 1.11771e-10 ] [ 3.18438e-11 2.15889e-10 3.01891e-10 ] [ 1.68585e-10 3.81794e-10 4.45016e-10 ] [ 2.72641e-10 -3.20403e-11 2.65546e-10 ] [ 4.33601e-10 7.481900000000001e-11 4.56114e-10 ] [ 3.14234e-10 2.88247e-10 7.698180000000001e-12 ] [ 4.12798e-10 3.93896e-10 1.35009e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 17.463484600000005 -37.537319600000004 35.667196100000005 ] [ -0.14527910000000002 -3.570712400000001 1.3302198000000003 ] [ -0.10293740000000003 0.9469341000000002 1.6278691000000005 ] [ -4.479500800000001 7.892928900000002 -8.132226300000001 ] [ -13.381095900000004 14.533904500000004 18.546915800000004 ] [ -18.862075900000004 37.645441100000006 -35.67969560000001 ] [ -1.5455674000000004 -17.084894100000003 -5.9240146000000005 ] [ 21.052972000000004 -2.8262826000000003 -7.4362644000000016 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.797958674382085e-08 -6.014141587061762e-08 5.714514772090894e-08 ] [ -2.327627775108653e-10 -5.72091192688066e-09 2.131247064085252e-09 ] [ -1.64923895685938e-10 1.51715567645829e-09 2.608133813742738e-09 ] [ -7.176951454614898e-09 1.264586615321667e-08 -1.302926285291489e-08 ] [ -2.143887901166274e-08 2.328588199883992e-08 2.971543488270614e-08 ] [ -3.022037702673513e-08 6.031464561012345e-08 -5.716517412758064e-08 ] [ -2.476271954150643e-09 -2.737301789586386e-08 -9.491317693397865e-09 ] [ 3.373057953675702e-08 -4.528203905493838e-09 -1.191420896776734e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -12.383632 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.984076567099075e-18 } }