{ "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" [ [ 2.146483 1.678803 1.689789 ] [ 0.9939717 3.024801 3.865516 ] [ 2.198915 3.863733 1.927968 ] [ 4.22715 2.33689 1.172014 ] [ 3.633184 2.755923 3.714191 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.146483e-10 1.678803e-10 1.689789e-10 ] [ 9.939717000000001e-11 3.024801e-10 3.865516e-10 ] [ 2.198915e-10 3.863733e-10 1.927968e-10 ] [ 4.22715e-10 2.33689e-10 1.172014e-10 ] [ 3.633184e-10 2.755923e-10 3.714191e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.9993718 -0.6816588 2.0838301 ] [ 2.8960643 -0.8736403 -1.949396 ] [ 1.083002 0.5063851 0.64708 ] [ -0.6728229 1.2525533 1.8832363 ] [ -2.3068716 -0.2036393 -2.6647504 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.601170133446814e-09 -1.092137792722583e-09 3.338663867939327e-09 ] [ 4.640006513793518e-09 -1.399726063648698e-09 -3.123276695881037e-09 ] [ 1.735160484679642e-09 8.113183683414701e-10 1.036736447787264e-09 ] [ -1.077981120318856e-09 2.006811613565889e-09 3.017277171301895e-09 ] [ -3.69601574470749e-09 -3.262661255360775e-10 -4.269400791147448e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.409038 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.109670691581879e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0436773 1.532385 1.9446003 ] [ 1.1991338 2.9347668 3.6374763 ] [ 2.3390967 4.0088643 1.878904 ] [ 4.0807366 2.5292871 1.3103046 ] [ 3.5370593 2.6548467 3.5981929 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0436773e-10 1.532385e-10 1.9446003e-10 ] [ 1.1991338e-10 2.9347668e-10 3.6374763e-10 ] [ 2.3390967e-10 4.0088643e-10 1.878904e-10 ] [ 4.0807366e-10 2.5292871e-10 1.3103046e-10 ] [ 3.5370593e-10 2.6548467e-10 3.5981929e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.6e-06 3.81e-05 9e-07 ] [ 6.71e-05 5.5e-06 -2.56e-05 ] [ -2.72e-05 -3.96e-05 -6e-07 ] [ -1.4e-05 8.1e-06 3.59e-05 ] [ -2.76e-05 -1.22e-05 -1.06e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.56348259328e-15 6.104292925248e-14 1.44195895872e-15 ] [ 1.0750605125568e-13 8.8119714144e-15 -4.101572149248001e-14 ] [ -4.357920408576e-14 -6.344619418368e-14 -9.6130597248e-16 ] [ -2.24304726912e-14 1.297763062848e-14 5.751814068672e-14 ] [ -4.422007473408001e-14 -1.954655477376e-14 -1.698307218048e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.115797 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.383123628295878e-18 } }