{ "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" [ 5.34161 0 0 ] "si-unit" "m" "si-value" [ 5.341610000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0977669 5.5284 0 ] "si-unit" "m" "si-value" [ -9.776690000000001e-12 5.5284e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.072801 -0.0524088 5.47046 ] "si-unit" "m" "si-value" [ -7.280100000000001e-12 -5.24088e-12 5.470460000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0796719 -0.127908 0.00668105 ] [ 1.22031 1.46092 1.38882 ] [ -0.251468 2.67688 2.66146 ] [ 1.14494 4.10147 3.98362 ] [ 2.6636 -0.086404 2.79747 ] [ 4.00012 1.38046 4.02333 ] [ 2.71061 2.85329 -0.00699576 ] [ 4.09739 4.08725 1.448 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -7.967190000000001e-12 -1.27908e-11 6.68105e-13 ] [ 1.22031e-10 1.46092e-10 1.38882e-10 ] [ -2.51468e-11 2.67688e-10 2.66146e-10 ] [ 1.14494e-10 4.10147e-10 3.98362e-10 ] [ 2.663600000000001e-10 -8.6404e-12 2.79747e-10 ] [ 4.00012e-10 1.38046e-10 4.02333e-10 ] [ 2.71061e-10 2.85329e-10 -6.99576e-13 ] [ 4.09739e-10 4.08725e-10 1.448e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.0557609 1.7734114 -1.0171864 ] [ 2.6177337 -1.2496901 -1.3821581 ] [ 1.303982 -1.1955431 0.7553039 ] [ 0.3996459 -0.6294995 1.1070224 ] [ -1.0006182 0.762968 -1.9215847 ] [ -0.7536122 -1.0051324 3.0084923 ] [ -1.6819341 -0.6786606 -0.5986836 ] [ -1.940958 2.2221464 0.0487942 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.691515431134767e-09 2.841318284140197e-09 -1.629712269075717e-09 ] [ 4.194071733620281e-09 -2.002224261465214e-09 -2.214461394069349e-09 ] [ 2.089209474344025e-09 -1.915471203978757e-09 1.210130250179061e-09 ] [ 6.403033175785747e-10 -1.00856938170529e-09 1.773645407981906e-09 ] [ -1.603167086386979e-09 1.222409492018534e-09 -3.078718081226982e-09 ] [ -1.207419847989654e-09 -1.610399632088594e-09 4.82013602691682e-09 ] [ -2.694755492746289e-09 -1.087334146778101e-09 -9.59196867176379e-10 ] [ -3.109757529554726e-09 3.560271010074886e-09 7.817692647063937e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -217.38979 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.482968391386217e-17 } }