{ "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" [ [ 2.06977 2.12479 1.528563 ] [ 2.041317 1.533814 3.912889 ] [ 1.700439 5.299543 2.410292 ] [ 0.6511626 3.199571 3.041419 ] [ 2.983959 3.688065 3.444542 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.06977e-10 2.12479e-10 1.528563e-10 ] [ 2.041317e-10 1.533814e-10 3.912889e-10 ] [ 1.700439e-10 5.299543e-10 2.410292e-10 ] [ 6.511626e-11 3.199571e-10 3.041419e-10 ] [ 2.983959e-10 3.688065e-10 3.444542e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.439785 -0.6454077 -0.7039337 ] [ 0.5803604 -0.9681628 0.5788173 ] [ -0.3531069 -0.1431926 0.2216012 ] [ -3.2129609 1.1247037 -0.5470384 ] [ 2.5459224 0.6320594 0.4505535 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.04613245178528e-10 -1.0340571278243e-09 -1.127826116733241e-09 ] [ 9.298398645181364e-10 -1.551167803288266e-09 9.273675457745798e-10 ] [ -5.657396198231636e-10 -2.294198359915661e-10 3.55044261781225e-10 ] [ -5.147730837524527e-09 1.801973973467257e-09 -8.764521351598388e-10 ] [ 4.079017347651026e-09 1.012670793636876e-09 7.218662841196128e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -12.31044 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.972349915976115e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.1955818 1.5204747 2.1418381 ] [ 3.0401453 1.7316481 3.4465605 ] [ 1.606846 5.0765275 2.9581952 ] [ 0.3097617 3.5877261 1.8400023 ] [ 3.2943128 3.9294067 3.951109 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1955818e-10 1.5204747e-10 2.1418381e-10 ] [ 3.0401453e-10 1.7316481e-10 3.4465605e-10 ] [ 1.606846e-10 5.0765275e-10 2.9581952e-10 ] [ 3.097617e-11 3.5877261e-10 1.8400023e-10 ] [ 3.2943128e-10 3.9294067e-10 3.951109e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.1e-06 5.6e-06 -1.5e-06 ] [ 8.8e-06 -1.8e-06 1e-05 ] [ -8.1e-06 -1.5e-06 -5.3e-06 ] [ -8.8e-06 7.3e-06 -2.9e-06 ] [ 6e-06 -9.7e-06 -2e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.36457090368e-15 8.972189076479999e-15 -2.4032649312e-15 ] [ 1.409915426304e-14 -2.88391791744e-15 1.6021766208e-14 ] [ -1.297763062848e-14 -2.4032649312e-15 -8.491536090240001e-15 ] [ -1.409915426304e-14 1.169588933184e-14 -4.646312200320001e-15 ] [ 9.6130597248e-15 -1.554111322176e-14 -3.2043532416e-16 ] ] } "relaxed-potential-energy" { "source-value" -15.066442 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.41391011310392e-18 } }