{ "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" [ 5.47225 0 0 ] "si-unit" "m" "si-value" [ 5.47225e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0720088 5.55574 0 ] "si-unit" "m" "si-value" [ -7.20088e-12 5.55574e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0610026 -0.0268755 5.37267 ] "si-unit" "m" "si-value" [ -6.10026e-12 -2.68755e-12 5.37267e-10 ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.7796232000000002 0.09025920000000001 -1.4900317000000003 ] [ 1.1937520000000001 -0.4072559000000001 -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 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.249094074364309e-09 1.446111812435328e-10 -2.387293973659298e-09 ] [ 1.912601561190768e-09 -6.524958870386407e-10 -1.554341727979969e-09 ] [ -5.341978935259434e-10 -2.737986886845378e-10 2.889787034645669e-09 ] [ -3.52313034198381e-10 1.753918142135487e-09 -1.2894317550432e-11 ] [ -1.804060342726141e-09 -6.405176780657635e-09 -4.55214382628366e-09 ] [ 2.909267099250158e-09 5.407392442654723e-09 3.795697437489792e-09 ] [ 1.15779692279376e-09 -8.589163191216158e-10 1.606834161475038e-10 ] [ -4.53818838714853e-09 8.844660696863504e-10 1.660505957190394e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.96485 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.76220423153149e-18 } }