{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.46856e-10 0.0 0.0 ] "source-value" [ 5.46856 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.09414e-11 5.47364e-10 0.0 ] "source-value" [ 0.109414 5.47364 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 8.53482e-12 1.88746e-11 5.50226e-10 ] "source-value" [ 0.0853482 0.188746 5.50226 ] } "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" [ [ -2.20359286874449e-09 -1.950426852620723e-09 -1.00292331129359e-09 ] [ -2.051603184700608e-10 -1.345011251395392e-10 3.623364404966665e-09 ] [ 2.232015321779819e-09 -1.228459471156337e-09 -2.316212266685453e-10 ] [ -1.906383337750255e-09 2.134834657974547e-10 -1.368438758597716e-09 ] [ -4.442284620720845e-10 -6.336919357528436e-10 -3.012424178317492e-09 ] [ 6.44244992501067e-10 1.250616612516029e-09 1.530692626945091e-09 ] [ 8.858338405805953e-11 -2.192151565277695e-09 -2.300439158289001e-09 ] [ 1.794521288697944e-09 4.675130711415992e-09 2.761789601254589e-09 ] ] "source-value" [ [ -1.3753745 -1.2173607 -0.6259755 ] [ -0.128051 -0.083949 2.2615262 ] [ 1.3931144 -0.7667441 -0.1445666 ] [ -1.1898709 0.1332459 -0.8541123 ] [ -0.2772656 -0.3955194 -1.8802073 ] [ 0.4021061 0.7805735 0.9553832 ] [ 0.0552894 -1.3682334 -1.4358212 ] [ 1.1200521 2.9179871 1.7237735 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.11998e-11 5.98912e-13 -1.42628e-11 ] [ 1.42992e-10 1.39997e-10 1.14788e-10 ] [ 3.44059e-12 2.83471e-10 2.60329e-10 ] [ 1.5648e-10 4.17845e-10 4.01026e-10 ] [ 2.81953e-10 7.576710000000001e-13 2.62729e-10 ] [ 4.17997e-10 1.38562e-10 3.91338e-10 ] [ 2.81257e-10 2.67111e-10 -1.66315e-11 ] [ 4.15871e-10 3.96748e-10 1.06238e-10 ] ] "source-value" [ [ 0.111998 0.00598912 -0.142628 ] [ 1.42992 1.39997 1.14788 ] [ 0.0344059 2.83471 2.60329 ] [ 1.5648 4.17845 4.01026 ] [ 2.81953 0.00757671 2.62729 ] [ 4.17997 1.38562 3.91338 ] [ 2.81257 2.67111 -0.166315 ] [ 4.15871 3.96748 1.06238 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.824359664755852e-18 "source-value" -36.352794 } }