{ "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" [ [ 2.9209956 3.3020465 -1.3248022 ] [ 1.3037113 -1.8299984 -0.9190592 ] [ 4.7016324 -0.3072712 1.3380337 ] [ 3.2001181 -0.9514783 5.2100867 ] [ -0.0023206 1.2255036 -1.9434482 ] [ -2.3376618 -1.8273915 2.9667678 ] [ -1.6912751 -1.5787305 -0.4573572 ] [ -8.0951999 1.9673197 -4.8702214 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.67995089833681e-09 5.290461746681481e-09 -2.122567129511795e-09 ] [ 2.088775782341764e-09 -2.931980676737386e-09 -1.472495175502733e-09 ] [ 7.532845572937341e-09 -4.923027369411408e-10 2.143766329644566e-09 ] [ 5.127154445860475e-09 -1.524436300018042e-09 8.347479171854166e-09 ] [ -3.7180110968604e-12 1.963473232802882e-09 -3.113747295429358e-09 ] [ -3.74534711415438e-09 -2.927803962470211e-09 4.753286047663585e-09 ] [ -2.709721446886013e-09 -2.529405118483137e-09 -7.327670192316647e-10 ] [ -1.296994012733914e-08 3.15199365494789e-09 -7.802954929486766e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.906723 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.592673596011038e-18 } }