{ "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" [ [ 2.719922 0.6324479 2.001085 ] [ 1.570016 2.535953 2.950979 ] [ 1.512501 2.471908 5.050939 ] [ 3.556391 2.380181 1.668166 ] [ 3.168972 1.023761 5.396195 ] [ 4.64835 1.331065 3.67677 ] [ 3.603196 3.529371 4.833641 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.719922e-10 6.324478999999999e-11 2.001085e-10 ] [ 1.570016e-10 2.535953e-10 2.950979e-10 ] [ 1.512501e-10 2.471908e-10 5.050939e-10 ] [ 3.556391e-10 2.380181e-10 1.668166e-10 ] [ 3.168972e-10 1.023761e-10 5.396195e-10 ] [ 4.64835e-10 1.331065e-10 3.67677e-10 ] [ 3.603196e-10 3.529371e-10 4.833641e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.3722234 -11.5932975 1.5900902 ] [ -5.0296773 -0.2139088 -5.9459093 ] [ -3.6314104 1.3399264 3.8349583 ] [ 6.3687027 10.7747954 -2.9979742 ] [ 1.0136114 -2.535694 2.634416 ] [ 1.2535242 0.4000506 -1.5677652 ] [ 4.3974729 1.8281279 2.4521842 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.005074112394687e-09 -1.857451021247909e-08 2.547605343403196e-09 ] [ -8.05843138022847e-09 -3.427196783433831e-10 -9.526396869857295e-09 ] [ -5.818160843409977e-09 2.146798751672709e-09 6.144280530002912e-09 ] [ 1.020378657076584e-08 1.726312528378338e-08 -4.803284173001584e-09 ] [ 1.623984487656357e-09 -4.062629644302835e-09 4.220799724661453e-09 ] [ 2.008367166847023e-09 6.409517184570124e-10 -2.511836750343836e-09 ] [ 7.045528270981577e-09 2.9289837812122e-09 3.928832195135152e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.868071 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.901474589019448e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7505036 0.3499739 2.0519996 ] [ 1.2684416 2.3282064 2.6076766 ] [ 1.5476245 2.7053143 4.9053673 ] [ 3.5359899 2.7557872 1.5616933 ] [ 3.1930563 0.9477589 5.6941904 ] [ 4.5051971 1.4640726 3.5529728 ] [ 3.9785349 3.3535737 5.2038751 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7505036e-10 3.499739e-11 2.0519996e-10 ] [ 1.2684416e-10 2.3282064e-10 2.6076766e-10 ] [ 1.5476245e-10 2.7053143e-10 4.905367300000001e-10 ] [ 3.5359899e-10 2.7557872e-10 1.5616933e-10 ] [ 3.1930563e-10 9.477589e-11 5.6941904e-10 ] [ 4.5051971e-10 1.4640726e-10 3.5529728e-10 ] [ 3.9785349e-10 3.3535737e-10 5.203875100000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7e-07 1.7e-05 -1.48e-05 ] [ -1.2e-06 -7e-06 2.2e-05 ] [ -1.2e-05 9e-07 -2.09e-05 ] [ -5.7e-06 -1.48e-05 -9.5e-06 ] [ 1.21e-05 2.44e-05 -1.13e-05 ] [ 3.7e-06 -1.73e-05 5.1e-06 ] [ 2.4e-06 -3.3e-06 2.94e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.12152363456e-15 2.72370025536e-14 -2.371221398784e-14 ] [ -1.92261194496e-15 -1.12152363456e-14 3.52478856576e-14 ] [ -1.92261194496e-14 1.44195895872e-15 -3.348549137472e-14 ] [ -9.13240673856e-15 -2.371221398784e-14 -1.52206778976e-14 ] [ 1.938633711168e-14 3.909310954752e-14 -1.810459581504e-14 ] [ 5.928053496960001e-15 -2.771765553984e-14 8.17110076608e-15 ] [ 3.84522388992e-15 -5.28718284864e-15 4.710399265152e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.381594 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.624620691823756e-18 } }