{ "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" [ [ 2.872342 2.592209 3.748836 ] [ 1.410068 4.838391 2.869154 ] [ 2.889421 3.430048 1.520903 ] [ 4.604684 2.417867 2.466033 ] [ 4.898299 2.012755 4.844446 ] [ 5.379024 4.52793 1.309626 ] [ 5.720081 4.239448 3.464417 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.872342e-10 2.592209e-10 3.748836e-10 ] [ 1.410068e-10 4.838391e-10 2.869154e-10 ] [ 2.889421e-10 3.430048e-10 1.520903e-10 ] [ 4.604684e-10 2.417867e-10 2.466033e-10 ] [ 4.898299e-10 2.012755e-10 4.844446e-10 ] [ 5.379024e-10 4.52793e-10 1.309626e-10 ] [ 5.720081000000001e-10 4.239448000000001e-10 3.464417e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.7769313 -1.2468318 6.7626146 ] [ -0.145991 0.4165603 0.2818295 ] [ -4.5116967 3.4487327 -6.7400638 ] [ 6.4663873 -7.9997366 -5.2164848 ] [ 2.51574 -1.3880394 5.1513219 ] [ 0.6817753 3.5734438 -5.0276909 ] [ 3.7707164 3.195871 4.7884735 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.406219413122775e-08 -1.997644760029982e-09 1.083490300760074e-08 ] [ -2.339033670472128e-10 6.674031738134342e-10 4.515406359517537e-10 ] [ -7.228534972880511e-09 5.52547890332846e-09 -1.079877264306041e-08 ] [ 1.036029455309804e-08 -1.281699095307808e-08 -8.357729989318563e-09 ] [ 4.030659812011393e-09 -2.22388427542926e-09 8.253327514395037e-09 ] [ 1.092324446298906e-09 5.725288112102712e-09 -8.05524881658891e-09 ] [ 6.041353659747141e-09 5.120349799292717e-09 7.67198029102035e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.8879788 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.584228846032604e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5561893 3.1912256 4.7527439 ] [ 1.6993683 4.0314051 2.7237674 ] [ 3.4203226 3.5810309 1.1772878 ] [ 4.2866363 1.5414857 1.9694656 ] [ 4.6733559 2.352317 4.144509 ] [ 5.1406368 5.1006715 1.7133219 ] [ 5.9974098 4.2605121 3.7423194 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5561893e-10 3.1912256e-10 4.7527439e-10 ] [ 1.6993683e-10 4.0314051e-10 2.7237674e-10 ] [ 3.4203226e-10 3.5810309e-10 1.1772878e-10 ] [ 4.2866363e-10 1.5414857e-10 1.9694656e-10 ] [ 4.6733559e-10 2.352317e-10 4.144509e-10 ] [ 5.1406368e-10 5.1006715e-10 1.7133219e-10 ] [ 5.9974098e-10 4.2605121e-10 3.7423194e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.6e-06 -2.24e-05 -2.47e-05 ] [ 2.44e-05 9.7e-06 -1.37e-05 ] [ -1.38e-05 4.94e-05 2.56e-05 ] [ 3.96e-05 -1.71e-05 1.92e-05 ] [ -6.45e-05 -8.3e-06 2.12e-05 ] [ -6.5e-05 -6.5e-06 -4.55e-05 ] [ 6.95e-05 -4.7e-06 1.79e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.538089555968e-14 -3.588875630592e-14 -3.957376253376001e-14 ] [ 3.909310954752e-14 1.554111322176e-14 -2.194981970496e-14 ] [ -2.211003736704e-14 7.914752506752001e-14 4.101572149248001e-14 ] [ 6.344619418368e-14 -2.739722021568e-14 3.076179111936e-14 ] [ -1.033403920416e-13 -1.329806595264e-14 3.396614436096001e-14 ] [ -1.04141480352e-13 -1.04141480352e-14 -7.28990362464e-14 ] [ 1.113512751456e-13 -7.53023011776e-15 2.867896151232001e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.282051 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.929107469247326e-18 } }