{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.47225e-10 0.0 0.0 ] "source-value" [ 5.47225 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -7.20088e-12 5.55574e-10 0.0 ] "source-value" [ -0.0720088 5.55574 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -6.10026e-12 -2.68755e-12 5.37267e-10 ] "source-value" [ -0.0610026 -0.0268755 5.37267 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.249094064073283e-09 1.446111800521114e-10 -2.38729395399088e-09 ] [ 1.912601545433242e-09 -6.524960418805248e-10 -1.554341715174071e-09 ] [ -5.341978891247981e-10 -2.737986864287674e-10 2.889787010837314e-09 ] [ -3.523130312957472e-10 1.75391812768532e-09 -1.28943174441984e-11 ] [ -1.804060327862863e-09 -6.405176727886715e-09 -4.552143788779494e-09 ] [ 2.909267075281311e-09 5.407392398104341e-09 3.795697406217831e-09 ] [ 1.157796913254912e-09 -8.589163120451828e-10 1.606834148236666e-10 ] [ -4.53818834975934e-09 8.844660623994183e-10 1.660505943509831e-09 ] ] "source-value" [ [ 0.7796232000000002 0.09025920000000001 -1.4900317000000003 ] [ 1.1937520000000001 -0.4072560000000001 -0.9701438000000002 ] [ -0.33342010000000005 -0.17089170000000004 1.8036632000000004 ] [ -0.21989650000000005 1.0947096000000003 -0.008048000000000001 ] [ -1.1260059000000002 -3.997796900000001 -2.8412247000000006 ] [ 1.8158217000000005 3.375028900000001 2.3690880000000005 ] [ 0.7226400000000001 -0.5360934000000002 0.10029070000000002 ] [ -2.8325144000000004 0.5520403000000002 1.0364063000000001 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.05094e-12 -7.580470000000001e-12 1.42316e-11 ] [ 1.30951e-10 1.38319e-10 1.48801e-10 ] [ -6.02099e-12 2.69484e-10 2.70363e-10 ] [ 1.30902e-10 4.05591e-10 4.11478e-10 ] [ 2.76224e-10 8.53385e-12 2.86654e-10 ] [ 4.01949e-10 1.17816e-10 4.04456e-10 ] [ 2.72232e-10 2.71295e-10 6.983420000000001e-12 ] [ 4.15368e-10 4.127030000000001e-10 1.42088e-10 ] ] "source-value" [ [ 0.0205094 -0.0758047 0.142316 ] [ 1.30951 1.38319 1.48801 ] [ -0.0602099 2.69484 2.70363 ] [ 1.30902 4.05591 4.11478 ] [ 2.76224 0.0853385 2.86654 ] [ 4.01949 1.17816 4.04456 ] [ 2.72232 2.71295 0.0698342 ] [ 4.15368 4.12703 1.42088 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.762204184057888e-18 "source-value" -35.96485 } }