{ "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" [ [ 1.222424 2.904477 0.9358623 ] [ 1.494107 1.000567 2.599919 ] [ 2.753047 4.765039 1.902757 ] [ 2.502796 3.18307 3.733295 ] [ 3.53967 2.110225 1.931082 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.222424e-10 2.904477e-10 9.358623e-11 ] [ 1.494107e-10 1.000567e-10 2.599919e-10 ] [ 2.753047e-10 4.765039e-10 1.902757e-10 ] [ 2.502796e-10 3.18307e-10 3.733295e-10 ] [ 3.53967e-10 2.110225e-10 1.931082e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1310981 0.1809588 -0.2251952 ] [ -0.2660104 0.1752593 0.0152306 ] [ -0.3776327 -0.4938065 -0.1614153 ] [ -0.1262102 0.3368321 1.1021598 ] [ 0.6387552 -0.1992438 -0.7307798 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.100423108513005e-10 2.899279586880231e-10 -3.608024845563802e-10 ] [ -4.261956437696563e-10 2.807963530377734e-10 2.440211124075648e-11 ] [ -6.050342831895801e-10 -7.911652294990753e-10 -2.586158198994183e-10 ] [ -2.022110317464921e-10 5.396645157549678e-10 1.765854663945604e-09 ] [ 1.023398647854428e-09 -3.19223758199351e-10 -1.1708383105129e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.9369699 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.592078085537331e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3357546 2.8067005 0.7109384 ] [ 1.3718711 1.3390176 2.7049915 ] [ 2.5656073 4.5481879 1.9704341 ] [ 2.6017211 3.0805078 3.9644892 ] [ 3.6370898 2.1889642 1.7520621 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3357546e-10 2.8067005e-10 7.109384e-11 ] [ 1.3718711e-10 1.3390176e-10 2.7049915e-10 ] [ 2.5656073e-10 4.5481879e-10 1.9704341e-10 ] [ 2.6017211e-10 3.0805078e-10 3.9644892e-10 ] [ 3.6370898e-10 2.1889642e-10 1.7520621e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.1e-06 -1e-06 -1.15e-05 ] [ 7e-06 1.26e-05 2e-07 ] [ -3.7e-06 -8.4e-06 5e-07 ] [ 2.7e-06 -3.6e-06 1.09e-05 ] [ -3.9e-06 3e-07 -1e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.36457090368e-15 -1.6021766208e-15 -1.84250311392e-14 ] [ 1.12152363456e-14 2.018742542208e-14 3.2043532416e-16 ] [ -5.928053496960001e-15 -1.345828361472e-14 8.010883104e-16 ] [ 4.32587687616e-15 -5.76783583488e-15 1.746372516672e-14 ] [ -6.24848882112e-15 4.8065298624e-16 -1.6021766208e-16 ] ] } "relaxed-potential-energy" { "source-value" -10.344766 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.657414223284673e-18 } }