{ "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" [ [ 2.841627 2.849258 1.50686 ] [ 0.998489 4.149663 3.105849 ] [ 4.765797 1.647113 1.498592 ] [ 3.299037 1.906995 3.475865 ] [ 3.256514 4.175642 3.223298 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.841627e-10 2.849258e-10 1.50686e-10 ] [ 9.98489e-11 4.149663e-10 3.105849e-10 ] [ 4.765797e-10 1.647113e-10 1.498592e-10 ] [ 3.299037e-10 1.906995e-10 3.475865e-10 ] [ 3.256514e-10 4.175642e-10 3.223298000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.7441752 0.2505801 -5.0665762 ] [ -0.3971097 -0.3370691 0.4821399 ] [ 0.3133351 -0.2122986 1.0215908 ] [ 0.5603957 -1.8009919 2.0293211 ] [ 1.2675541 2.0997795 1.5335244 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.794476751042277e-09 4.014735811653833e-10 -8.11755000202051e-09 ] [ -6.362398824747498e-10 -5.400442360634093e-10 7.724732820990966e-10 ] [ 5.020181758320534e-10 -3.401398563509124e-10 1.636768909269367e-09 ] [ 8.978528963340737e-10 -2.885507140203264e-09 3.251330849303178e-09 ] [ 2.030845561350899e-09 3.364217651452203e-09 2.456976961348869e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.42457404636885 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.6702008956495e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.010211 3.0510015 1.2578506 ] [ 1.0139709 3.863975 3.2655595 ] [ 4.5630684 1.44182 1.6601922 ] [ 3.3214838 2.043993 3.4653434 ] [ 3.25273 4.3278816 3.1615184 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.010211e-10 3.0510015e-10 1.2578506e-10 ] [ 1.0139709e-10 3.863975e-10 3.2655595e-10 ] [ 4.5630684e-10 1.44182e-10 1.6601922e-10 ] [ 3.321483800000001e-10 2.043993e-10 3.4653434e-10 ] [ 3.25273e-10 4.3278816e-10 3.1615184e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.3e-06 4.45e-05 -3.08e-05 ] [ -1.88e-05 -2.61e-05 5.9e-06 ] [ -1.02e-05 -3.04e-05 1.4e-06 ] [ 7.4e-06 2.5e-05 2.93e-05 ] [ 1.24e-05 -1.31e-05 -5.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.49002426962e-14 7.129686021299999e-14 -4.93470403272e-14 ] [ -3.012092071919999e-14 -4.18168101474e-14 9.452842140600001e-15 ] [ -1.63422016668e-14 -4.870616967359999e-14 2.2430472876e-15 ] [ 1.18561070916e-14 4.005441585e-14 4.69437753762e-14 ] [ 1.98669902616e-14 -2.09885139054e-14 -9.2926244772e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.31988604636885 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.813645692303481e-18 } }