{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.965438 2.618572 1.194827 ] [ 1.728438 2.327042 2.925955 ] [ 2.189414 4.329945 2.407266 ] [ 3.949135 1.445792 2.998392 ] [ 4.502281 4.108784 2.139004 ] [ 4.146323 3.387836 4.449004 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.965438e-10 2.618572e-10 1.194827e-10 ] [ 1.728438e-10 2.327042e-10 2.925955e-10 ] [ 2.189414e-10 4.329945000000001e-10 2.407266e-10 ] [ 3.949135e-10 1.445792e-10 2.998392e-10 ] [ 4.502281e-10 4.108784e-10 2.139004e-10 ] [ 4.146323e-10 3.387836e-10 4.449004000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 5.3772952 -5.7572398 -14.3892912 ] [ -9.4070121 -5.0396525 7.999047 ] [ -5.3781543 11.6731989 3.9313366 ] [ 3.2402033 -6.0148679 2.0529004 ] [ 6.1233709 4.4132721 -1.6548565 ] [ 0.0442971 0.7252891 2.0608637 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.61537665258006e-09 -9.224115007899268e-09 -2.305418595052318e-08 ] [ -1.507169485820271e-08 -8.074413412456272e-09 1.281588609208038e-08 ] [ -8.61675308251499e-09 1.870252636752828e-08 6.298695589015361e-09 ] [ 5.191377973899009e-09 -9.636880726580392e-09 3.289109025710968e-09 ] [ 9.810721696467055e-09 7.07084137984892e-09 -2.651372395078915e-09 ] [ 7.097177798923967e-11 1.162041239341073e-09 3.301867638795385e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.1948838 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.925297992932664e-19 } "relaxed-configuration-positions" { "source-value" [ [ 4.1102285 2.2766273 0.7861712 ] [ 1.3456634 2.5292782 3.2017422 ] [ 1.7669821 4.4309721 2.6326861 ] [ 3.3881687 1.4092964 3.0704262 ] [ 4.05394 4.4143771 2.1711917 ] [ 4.8160463 3.1574199 4.2522305 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.1102285e-10 2.2766273e-10 7.861712e-11 ] [ 1.3456634e-10 2.5292782e-10 3.2017422e-10 ] [ 1.7669821e-10 4.4309721e-10 2.6326861e-10 ] [ 3.3881687e-10 1.4092964e-10 3.0704262e-10 ] [ 4.05394e-10 4.414377100000001e-10 2.1711917e-10 ] [ 4.8160463e-10 3.1574199e-10 4.2522305e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.2e-06 -2.89e-05 -3.56e-05 ] [ -3.5e-05 -1.95e-05 1.48e-05 ] [ -3.08e-05 4.01e-05 -3e-06 ] [ 2.59e-05 3.6e-06 -2.82e-05 ] [ 3.15e-05 -2.51e-05 2.88e-05 ] [ 1.15e-05 2.98e-05 2.33e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.126965186560001e-15 -4.630290434112001e-14 -5.703748770048e-14 ] [ -5.6076181728e-14 -3.12424441056e-14 2.371221398784e-14 ] [ -4.934703992064001e-14 6.424728249408e-14 -4.8065298624e-15 ] [ 4.149637447872e-14 5.76783583488e-15 -4.518138070656001e-14 ] [ 5.04685635552e-14 -4.021463318208e-14 4.614268667904e-14 ] [ 1.84250311392e-14 4.774486329984001e-14 3.733071526464e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.314433 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.453642651340801e-18 } }