{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.421878 2.270641 0.131256 ] [ 0.1151872 2.83342 1.501847 ] [ 1.874433 0.2983712 0.2433776 ] [ 2.499725 0.6406393 2.506935 ] [ 1.789352 2.803582 2.39627 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.21878e-11 2.270641e-10 1.31256e-11 ] [ 1.151872e-11 2.83342e-10 1.501847e-10 ] [ 1.874433e-10 2.983712e-11 2.433776e-11 ] [ 2.499725e-10 6.406393e-11 2.506935e-10 ] [ 1.789352e-10 2.803582e-10 2.39627e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 299.6128273 -531.0285384 -1279.2012883 ] [ -369.4214815 528.8929652 1247.4516007 ] [ -5.4936045 4.5984815 -4.2983076 ] [ 2.2075242 -3.9638986 4.7777968 ] [ 73.0947346 1.5009904 31.2701985 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.800326711467372e-07 -8.508015162116517e-07 -2.049506414296957e-06 ] [ -5.918784657569632e-07 8.473799507304152e-07 1.998637806687438e-06 ] [ -8.801724766337253e-09 7.367579611181271e-09 -6.886648002464619e-09 ] [ 3.536843692229543e-09 -6.350865716465312e-09 7.65487439495997e-09 ] [ 1.171106758445513e-07 2.404851746738313e-09 5.010038137724184e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 276.38767 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.428218667997028e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.1257585 1.8382484 -0.4043208 ] [ 0.0526591 3.4714953 1.5071227 ] [ 1.8764127 0.1092092 0.1172887 ] [ 2.8858663 0.6743742 2.3506838 ] [ 1.7598786 2.7533264 3.2089112 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.257585e-11 1.8382484e-10 -4.043208e-11 ] [ 5.26591e-12 3.4714953e-10 1.5071227e-10 ] [ 1.8764127e-10 1.092092e-11 1.172887e-11 ] [ 2.8858663e-10 6.743742000000001e-11 2.3506838e-10 ] [ 1.7598786e-10 2.7533264e-10 3.2089112e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.93e-05 1.09e-05 3.87e-05 ] [ 2.12e-05 2.13e-05 -3.32e-05 ] [ 2.81e-05 3.6e-06 5.06e-05 ] [ 1.17e-05 -1.06e-05 -5.55e-05 ] [ -4.17e-05 -2.52e-05 -7e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.09220090362e-14 1.74637253106e-14 6.200423573579999e-14 ] [ 3.39661446408e-14 3.41263623042e-14 -5.31922642488e-14 ] [ 4.50211634154e-14 5.767835882399999e-15 8.107013768039999e-14 ] [ 1.87454666178e-14 -1.69830723204e-14 -8.892080318699998e-14 ] [ -6.681076563779999e-14 -4.037485117679999e-14 -1.1215236438e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.851117 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.539628928020018e-18 } }