{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.891577 1.147444 4.176951 ] [ 1.947528 5.315412 2.001915 ] [ 3.037668 3.274696 0.9821769 ] [ 1.344392 3.383525 2.90788 ] [ 3.679276 1.837825 2.704146 ] [ 4.016034 4.351153 3.141989 ] [ 3.129852 3.103182 4.716137 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.891577e-10 1.147444e-10 4.176951e-10 ] [ 1.947528e-10 5.315412000000001e-10 2.001915e-10 ] [ 3.037668e-10 3.274696e-10 9.821769000000001e-11 ] [ 1.344392e-10 3.383525e-10 2.90788e-10 ] [ 3.679276000000001e-10 1.837825e-10 2.704146e-10 ] [ 4.016034e-10 4.351153e-10 3.141989e-10 ] [ 3.129852e-10 3.103182e-10 4.716137e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.6668177 -1.8916965 0.3304936 ] [ 0.2623414 3.3895239 -1.0776008 ] [ 0.4190825 -0.0823525 -2.8959704 ] [ -9.0954708 -1.8321875 1.2530624 ] [ 4.3420784 -4.7823067 -1.6197148 ] [ 5.9039554 4.7954382 -1.0897641 ] [ -0.1651692 0.4035813 5.099494 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.670536372077622e-09 -3.03083193091958e-09 5.295091236065424e-10 ] [ 4.203172612108476e-10 5.430615992964553e-09 -1.726506822539707e-09 ] [ 6.71444189218305e-10 -1.31943251251485e-10 -4.639856107635632e-09 ] [ -1.457255079098928e-08 -2.935488001606875e-09 2.007627298223961e-09 ] [ 6.956776555476105e-09 -7.662100051361647e-09 -2.595069206303983e-09 ] [ 9.459179390058123e-09 7.683139033831018e-09 -1.745994577592039e-09 ] [ -2.646302328964727e-10 6.46608528779344e-10 8.170290132023195e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.928559 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.23160117750904e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6792064 1.1026762 4.043812 ] [ 1.8981483 5.4405461 1.9444963 ] [ 3.1957295 3.2187982 1.3354051 ] [ 1.0902562 3.3238452 3.0292446 ] [ 3.7723884 1.294677 2.6873227 ] [ 4.0643481 4.9299914 3.0869709 ] [ 3.3462501 3.1027028 4.5039434 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6792064e-10 1.1026762e-10 4.043812e-10 ] [ 1.8981483e-10 5.4405461e-10 1.9444963e-10 ] [ 3.1957295e-10 3.2187982e-10 1.3354051e-10 ] [ 1.0902562e-10 3.3238452e-10 3.0292446e-10 ] [ 3.7723884e-10 1.294677e-10 2.6873227e-10 ] [ 4.0643481e-10 4.929991399999999e-10 3.0869709e-10 ] [ 3.3462501e-10 3.1027028e-10 4.5039434e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.7e-06 8.9e-06 -1.1e-06 ] [ -4.1e-06 -5e-06 -2.6e-06 ] [ 9.7e-06 9.1e-06 2.8e-06 ] [ 5e-07 -6.6e-06 1.14e-05 ] [ 1.4e-06 5.1e-06 2.6e-06 ] [ 5e-07 -6.4e-06 -2.6e-06 ] [ -1.4e-06 -5.1e-06 -1.04e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.07345834478e-14 1.42593720426e-14 -1.7623942974e-15 ] [ -6.568924199399999e-15 -8.010883169999999e-15 -4.165659248399999e-15 ] [ 1.55411133498e-14 1.45798073694e-14 4.486094575199999e-15 ] [ 8.010883169999999e-16 -1.05743657844e-14 1.82648136276e-14 ] [ 2.2430472876e-15 8.1711008334e-15 4.165659248399999e-15 ] [ 8.010883169999999e-16 -1.02539304576e-14 -4.165659248399999e-15 ] [ -2.2430472876e-15 -8.1711008334e-15 -1.66626369936e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.78446 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.689166962630764e-18 } }