{ "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" [ 5.55975 0 0 ] "si-unit" "m" "si-value" [ 5.55975e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00335003 5.48819 0 ] "si-unit" "m" "si-value" [ 3.35003e-13 5.488190000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0164792 -0.0422926 5.51812 ] "si-unit" "m" "si-value" [ 1.64792e-12 -4.22926e-12 5.51812e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0695878 -0.00317054 -0.0200442 ] [ 1.39636 1.32374 1.28539 ] [ -0.0674176 2.58156 2.68412 ] [ 1.50658 3.99879 4.14654 ] [ 2.80481 -0.0668971 2.57568 ] [ 4.18687 1.32364 3.96453 ] [ 2.74594 2.77319 -0.0797703 ] [ 4.04367 4.06467 1.27465 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.958780000000001e-12 -3.17054e-13 -2.00442e-12 ] [ 1.39636e-10 1.32374e-10 1.28539e-10 ] [ -6.74176e-12 2.58156e-10 2.68412e-10 ] [ 1.50658e-10 3.99879e-10 4.14654e-10 ] [ 2.80481e-10 -6.689710000000001e-12 2.57568e-10 ] [ 4.18687e-10 1.32364e-10 3.96453e-10 ] [ 2.74594e-10 2.77319e-10 -7.97703e-12 ] [ 4.04367e-10 4.06467e-10 1.27465e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.337803 -0.5603999 -0.957826 ] [ -0.1847427 0.1741255 -0.0550777 ] [ 1.4148106 2.2348212 -0.8727259 ] [ -2.3661569 1.5586035 -1.9702052 ] [ -1.0059076 0.418395 1.7089757 ] [ -1.2669259 -1.0755008 1.7789705 ] [ 0.86275 -2.3024686 0.2366825 ] [ 2.2083695 -0.447576 0.1312061 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.41220073495102e-10 -8.978596254759365e-10 -1.534606436637684e-09 ] [ -2.959904372420718e-10 2.789798074835669e-10 -8.824420399446179e-11 ] [ 2.26677648485552e-09 3.58057830780784e-09 -1.398261044866621e-09 ] [ -3.791001297557874e-09 2.497158109370619e-09 -3.156616735625297e-09 ] [ -1.611641652683018e-09 6.703426927824299e-10 2.738080934613793e-09 ] [ -2.02983907398942e-09 -1.723142251608307e-09 2.850224967675297e-09 ] [ 1.3822778909835e-09 -3.688961391438692e-09 3.792071711767049e-10 ] [ 3.538198012138262e-09 -7.170958091391839e-10 2.102153476582674e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -36.057535 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.777054005663719e-18 } }