{ "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" [ 5.37157 0 0 ] "si-unit" "m" "si-value" [ 5.37157e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00742946 5.44743 0 ] "si-unit" "m" "si-value" [ -7.42946e-13 5.447429999999999e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0324182 0.1292 5.41398 ] "si-unit" "m" "si-value" [ 3.24182e-12 1.292e-11 5.41398e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0294164 -0.0853048 -0.0527531 ] [ 1.50657 1.46533 1.29324 ] [ 0.0376731 2.77305 2.66982 ] [ 1.30492 4.09759 4.08062 ] [ 2.57907 0.017247 2.67471 ] [ 4.14556 1.36588 4.04305 ] [ 2.78643 2.5664 0.0569683 ] [ 4.11497 4.06206 1.21769 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.94164e-12 -8.530480000000001e-12 -5.27531e-12 ] [ 1.50657e-10 1.46533e-10 1.29324e-10 ] [ 3.76731e-12 2.77305e-10 2.66982e-10 ] [ 1.30492e-10 4.09759e-10 4.08062e-10 ] [ 2.57907e-10 1.7247e-12 2.67471e-10 ] [ 4.14556e-10 1.36588e-10 4.04305e-10 ] [ 2.78643e-10 2.5664e-10 5.69683e-12 ] [ 4.114969999999999e-10 4.06206e-10 1.21769e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 12.3236335 11.5162995 2.4233138 ] [ -42.4740022 -25.7593622 26.1373596 ] [ 2.6332876 -3.0960973 -4.2625828 ] [ 7.0012496 -6.4554516 2.5568201 ] [ 11.2532331 -3.1335783 1.9196981 ] [ -8.8576981 1.8672812 -3.5547779 ] [ 29.6327282 30.0306992 -36.4667732 ] [ -11.5124318 -4.9697904 11.2469422 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.974463763967964e-08 1.845114596904588e-08 3.882576747209748e-09 ] [ -6.80508538773046e-08 -4.127104822358283e-08 4.187666682557558e-08 ] [ 4.218991863321938e-09 -4.960494750650487e-09 -6.829410562650294e-09 ] [ 1.121723851792185e-08 -1.034277371543791e-08 4.096477421561543e-09 ] [ 1.802966712977538e-08 -5.020545933069441e-09 3.075695440154195e-09 ] [ -1.419159692684619e-08 2.991714307747481e-09 -5.695382090439588e-09 ] [ 4.747686472371287e-08 4.811448456092249e-08 -5.84262119384174e-08 ] [ -1.844494923047856e-08 -7.962482054757512e-09 1.801958799678855e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -28.138564 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.508294975511357e-18 } }