{ "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" [ [ 0.8164278 0.1663691 0.8726527 ] [ 0.2293415 1.783801 2.502887 ] [ 2.371717 0.4239938 0.3261347 ] [ 1.905698 2.704881 0.8462502 ] [ 2.020767 2.181943 2.752956 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.164278e-11 1.663691e-11 8.726527e-11 ] [ 2.293415e-11 1.783801e-10 2.502887e-10 ] [ 2.371717e-10 4.239938e-11 3.261347e-11 ] [ 1.905698e-10 2.704881e-10 8.462502e-11 ] [ 2.020767e-10 2.181943e-10 2.752956e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -29.830889 -25.0496138 -1.7573514 ] [ -23.8827816 -3.6427709 10.4968928 ] [ 24.7694436 -5.4582472 -16.3612003 ] [ 11.7653697 22.0231118 -16.9399922 ] [ 17.1788573 12.12752 24.561651 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.779435293347989e-08 -4.013390559042905e-08 -2.815587327610149e-09 ] [ -3.826443431919242e-08 -5.836362370910575e-09 1.681787623520385e-08 ] [ 3.968502344614418e-08 -8.745076054387062e-09 -2.621353260888595e-08 ] [ 1.885020026840871e-08 3.528491484322461e-08 -2.714085945937436e-08 ] [ 2.752356353811941e-08 1.943042901228442e-08 3.935210300044894e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 13.134803 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.10442742854137e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4090212 -0.1826724 1.0050117 ] [ 0.077257 1.2033763 2.8760884 ] [ 2.2053503 0.6906137 -0.2370432 ] [ 2.9837784 2.6163829 0.8664012 ] [ 1.6685445 2.9332875 2.7904226 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.090212e-11 -1.826724e-11 1.0050117e-10 ] [ 7.725700000000001e-12 1.2033763e-10 2.8760884e-10 ] [ 2.2053503e-10 6.906137000000001e-11 -2.370432e-11 ] [ 2.9837784e-10 2.6163829e-10 8.664012e-11 ] [ 1.6685445e-10 2.9332875e-10 2.7904226e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7e-07 2e-07 -7e-07 ] [ -1e-07 6e-07 8e-07 ] [ -2e-07 -5e-07 -3e-07 ] [ -3e-07 -0.0 4e-07 ] [ -1e-07 -3e-07 -2e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.12152363456e-15 3.2043532416e-16 -1.12152363456e-15 ] [ -1.6021766208e-16 9.6130597248e-16 1.28174129664e-15 ] [ -3.2043532416e-16 -8.010883104e-16 -4.8065298624e-16 ] [ -4.8065298624e-16 0.0 6.408706483200001e-16 ] [ -1.6021766208e-16 -4.8065298624e-16 -3.2043532416e-16 ] ] } "relaxed-potential-energy" { "source-value" -10.83321 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.735671579021677e-18 } }