{ "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" [ [ 2.10043 2.130682 2.453785 ] [ 1.948071 1.785129 4.606922 ] [ 2.343053 4.336787 1.957735 ] [ 4.413531 1.079857 2.965455 ] [ 3.524463 3.435576 3.796327 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.10043e-10 2.130682e-10 2.453785e-10 ] [ 1.948071e-10 1.785129e-10 4.606922e-10 ] [ 2.343053e-10 4.336787e-10 1.957735e-10 ] [ 4.413531e-10 1.079857e-10 2.965455e-10 ] [ 3.524463e-10 3.435576e-10 3.796327e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1109945 -3.2182013 -4.259599 ] [ 0.8699464 -1.3150418 2.5941873 ] [ -0.1874812 2.4776247 -1.1436532 ] [ -2.1926051 1.4412571 1.1649611 ] [ 2.6211344 0.6143613 1.6441039 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.780009413737386e-09 -5.156126883888167e-09 -6.82462993178306e-09 ] [ 1.393807783429125e-09 -2.106929227334749e-09 4.156346242036276e-09 ] [ -3.00377995479529e-10 3.969592369456613e-09 -1.832334419343107e-09 ] [ -3.512940629866846e-09 2.309148430182008e-09 1.866473438561451e-09 ] [ 4.199520255654635e-09 9.84315311584295e-10 2.634144830746101e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.848812 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.058606619145449e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0312386 2.0631069 2.2088128 ] [ 2.2160279 1.5950254 4.6633695 ] [ 2.367112 4.4577715 1.9055841 ] [ 4.13692 1.1410614 3.2058232 ] [ 3.5782496 3.5110658 3.7966343 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0312386e-10 2.0631069e-10 2.2088128e-10 ] [ 2.2160279e-10 1.5950254e-10 4.6633695e-10 ] [ 2.367112e-10 4.4577715e-10 1.9055841e-10 ] [ 4.13692e-10 1.1410614e-10 3.2058232e-10 ] [ 3.5782496e-10 3.5110658e-10 3.7966343e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.5e-05 4.6e-06 1.79e-05 ] [ 1.54e-05 1.7e-06 -2.54e-05 ] [ -2.8e-06 -4e-06 4.8e-06 ] [ -2.28e-05 8.6e-06 1.29e-05 ] [ -4.7e-06 -1.09e-05 -1.02e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.4032649312e-14 7.370012455680001e-15 2.867896151232001e-14 ] [ 2.467351996032e-14 2.72370025536e-15 -4.069528616832e-14 ] [ -4.48609453824e-15 -6.4087064832e-15 7.69044777984e-15 ] [ -3.652962695424e-14 1.377871893888e-14 2.066807840832e-14 ] [ -7.53023011776e-15 -1.746372516672e-14 -1.634220153216e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.797586 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.370834633347739e-18 } }