{ "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" [ [ 0.0140975 0.5833675 2.011711 ] [ 0.3860738 2.863563 1.325373 ] [ 1.128451 1.622429 0.5509609 ] [ 2.086312 0.6042059 2.517228 ] [ 2.318087 2.883056 0.8671461 ] [ 2.902063 1.818717 2.74846 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.40975e-12 5.833675e-11 2.011711e-10 ] [ 3.860738e-11 2.863563e-10 1.325373e-10 ] [ 1.128451e-10 1.622429e-10 5.509609e-11 ] [ 2.086312e-10 6.042059e-11 2.517228e-10 ] [ 2.318087e-10 2.883056e-10 8.671461e-11 ] [ 2.902063e-10 1.818717e-10 2.74846e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.0385674 -5.0967914 4.4899567 ] [ -29.7999122 31.2521052 19.5415131 ] [ -8.3482494 -45.1885361 -43.6019848 ] [ -27.6420473 -63.5856626 3.0818047 ] [ 29.8341198 34.0385976 -9.8077347 ] [ 45.9946565 48.5802873 26.296445 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.608355799460504e-08 -8.165960022174501e-09 7.193703653144318e-09 ] [ -4.77447226287327e-08 5.007139230222211e-08 3.130895542387693e-08 ] [ -1.337537001328763e-08 -7.240001606759682e-08 -6.985808066703695e-08 ] [ -4.428744193510777e-08 -1.018754620357969e-07 4.937595440211558e-09 ] [ 4.779952924570637e-08 5.4535845279539e-08 -1.57137232393489e-08 ] [ 7.369156332602675e-08 7.783420054380716e-08 4.213154938915306e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 27.26805 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.368823220480544e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.3431778 0.7689227 2.2095578 ] [ -0.102647 3.0796375 1.2172356 ] [ 1.3407553 1.1254554 0.2322783 ] [ 2.0743681 0.1055169 2.4666928 ] [ 2.4058523 3.2899824 1.0991414 ] [ 3.4599334 2.0058235 2.7959731 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.431778e-11 7.689227e-11 2.2095578e-10 ] [ -1.02647e-11 3.0796375e-10 1.2172356e-10 ] [ 1.3407553e-10 1.1254554e-10 2.322783e-11 ] [ 2.0743681e-10 1.055169e-11 2.4666928e-10 ] [ 2.4058523e-10 3.2899824e-10 1.0991414e-10 ] [ 3.459933400000001e-10 2.0058235e-10 2.7959731e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.5e-06 3.3e-06 -1e-07 ] [ -1.6e-06 7e-07 1.9e-06 ] [ 3.4e-06 -7.4e-06 3.9e-06 ] [ 9e-07 -3.1e-06 -6.8e-06 ] [ 5e-06 -1.8e-06 6.4e-06 ] [ -2.2e-06 8.3e-06 -5.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.8119714144e-15 5.28718284864e-15 -1.6021766208e-16 ] [ -2.56348259328e-15 1.12152363456e-15 3.04413557952e-15 ] [ 5.44740051072e-15 -1.185610699392e-14 6.24848882112e-15 ] [ 1.44195895872e-15 -4.96674752448e-15 -1.089480102144e-14 ] [ 8.010883104e-15 -2.88391791744e-15 1.025393037312e-14 ] [ -3.52478856576e-15 1.329806595264e-14 -8.491536090240001e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.047461 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.250651359579979e-18 } }