{ "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" [ [ 0.1501776 0.7389508 1.254214 ] [ 0.5251994 1.126951 2.894489 ] [ 1.795844 1.050789 0.3566565 ] [ 2.560887 2.159455 0.963327 ] [ 1.607121 2.890729 1.590789 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.501776e-11 7.389508e-11 1.254214e-10 ] [ 5.251994e-11 1.126951e-10 2.894489e-10 ] [ 1.795844e-10 1.050789e-10 3.566565e-11 ] [ 2.560887e-10 2.159455e-10 9.633270000000001e-11 ] [ 1.607121e-10 2.890729e-10 1.590789e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -17.3345878 -6.4117735 -22.951497 ] [ 8.228228 8.5618305 28.3571421 ] [ -15.8999753 -39.9825233 -29.3591565 ] [ 84.2823201 -2.2267393 -14.592496 ] [ -59.275985 40.0592055 38.5460074 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.777307153318146e-08 -1.02727936842004e-08 -3.677235220872109e-08 ] [ 1.318307464082455e-08 1.371756477136853e-08 4.543315047963769e-08 ] [ -2.547456890683714e-08 -6.405906459962056e-08 -4.703855453824922e-08 ] [ 1.350351639235285e-07 -3.567629676469516e-09 -2.337975612293846e-08 ] [ -9.497059812433448e-08 6.418192302870428e-08 6.175751239027109e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 31.149642 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.990722856986502e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.0297628 0.8714458 1.2563902 ] [ 0.3869532 1.1078772 3.112553 ] [ 1.9090482 0.497336 -0.0534665 ] [ 2.9363158 2.4544563 0.8083964 ] [ 1.4366745 3.0357595 1.9356024 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.97628e-12 8.714458e-11 1.2563902e-10 ] [ 3.869532e-11 1.1078772e-10 3.112553e-10 ] [ 1.9090482e-10 4.97336e-11 -5.34665e-12 ] [ 2.9363158e-10 2.4544563e-10 8.083964e-11 ] [ 1.4366745e-10 3.035759500000001e-10 1.9356024e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.69e-05 6.3e-06 -0.0003466 ] [ 0.0001345 5.49e-05 0.0003617 ] [ -9.65e-05 8.1e-05 4e-07 ] [ 6.24e-05 -9.67e-05 7.5e-05 ] [ -0.0001572 -4.56e-05 -9.05e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.116385047459999e-14 1.00937127942e-14 -5.553144213444e-13 ] [ 2.15492757273e-13 8.795949720659999e-14 5.795072885178e-13 ] [ -1.54610045181e-13 1.29776307354e-13 6.408706536e-16 ] [ 9.997582196159998e-14 -1.549304805078e-13 1.2016324755e-13 ] [ -2.518621668648e-13 -7.30592545104e-14 -1.44996985377e-13 ] ] } "relaxed-potential-energy" { "source-value" -10.934396 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.751883377810306e-18 } }