{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.9561271 0.2009027 2.827783 ] [ 0.6408175 2.004915 2.928704 ] [ 2.494403 2.793601 0.1007886 ] [ 2.213716 1.735143 2.110523 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.561271000000001e-11 2.009027e-11 2.827783e-10 ] [ 6.408175e-11 2.004915e-10 2.928704e-10 ] [ 2.494403e-10 2.793601e-10 1.007886e-11 ] [ 2.213716e-10 1.735143e-10 2.110523e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 34.8783769 -599.1973331 3.2459052 ] [ -277.2373721 565.3864058 117.735637 ] [ 5.8531727 48.6098757 -86.603893 ] [ 236.5058225 -14.7989484 -34.3776492 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.588132050102535e-08 -9.600199662479347e-07 5.200513467619097e-09 ] [ -4.441832396501835e-07 9.05848888554002e-07 1.886332865905058e-07 ] [ 9.377816534706691e-09 7.788160702818439e-08 -1.387547337780361e-07 ] [ 3.789241026144514e-07 -2.371052933425168e-08 -5.507906628008878e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 317.41611 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.085566746971737e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.7710297 -0.4122109 3.0396697 ] [ 0.1391336 2.5924683 2.4500809 ] [ 2.1297127 3.2084842 0.1191836 ] [ 3.2651876 1.3458201 2.3588643 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.710297e-11 -4.122109e-11 3.0396697e-10 ] [ 1.391336e-11 2.5924683e-10 2.4500809e-10 ] [ 2.1297127e-10 3.2084842e-10 1.191836e-11 ] [ 3.2651876e-10 1.3458201e-10 2.3588643e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.3e-06 3.99e-05 -2.1e-06 ] [ -6.13e-05 -1.06e-05 9.5e-06 ] [ 1.56e-05 -2.4e-06 8.7e-06 ] [ 3.63e-05 -2.69e-05 -1.61e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.49002426962e-14 6.392684769659999e-14 -3.364570931399999e-15 ] [ -9.821342766419999e-14 -1.69830723204e-14 1.5220678023e-14 ] [ 2.49939554904e-14 -3.845223921599999e-15 1.39389367158e-14 ] [ 5.81590118142e-14 -4.309855145459999e-14 -2.579504380739999e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.4802818 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.358690934969546e-18 } }