{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.2422976 0.2155702 0.7539187 ] [ 0.1069263 2.303076 0.5134626 ] [ 0.4438839 2.233015 2.726304 ] [ 2.36111 0.1695128 0.2725886 ] [ 2.483594 1.001172 2.982027 ] [ 2.63043 2.516837 1.068712 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.422976e-11 2.155702e-11 7.539187e-11 ] [ 1.069263e-11 2.303076e-10 5.134626e-11 ] [ 4.438839e-11 2.233015e-10 2.726304e-10 ] [ 2.36111e-10 1.695128e-11 2.725886e-11 ] [ 2.483594e-10 1.001172e-10 2.982027e-10 ] [ 2.63043e-10 2.516837e-10 1.068712e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.6819235 -2.9690446 1.1686524 ] [ 0.4780678 3.2337312 -1.3683234 ] [ 0.8123754 -0.4753372 0.7084275 ] [ 1.9595516 1.0434504 0.5063959 ] [ -0.4508539 0.4564982 -1.4386636 ] [ -1.1172173 -1.289298 0.4235111 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.694738509674109e-09 -4.756933844232488e-09 1.87238755312181e-09 ] [ 7.659490523172902e-10 5.181008526591529e-09 -2.192295761173567e-09 ] [ 1.301568873193048e-09 -7.615741488365338e-10 1.135025978031792e-09 ] [ 3.139547760771233e-09 1.671791835844408e-09 8.113356718489748e-10 ] [ -7.223475779765011e-10 7.313907434772827e-10 -2.304993185115963e-09 ] [ -1.7899794384133e-09 -2.065683112844198e-09 6.785395830692908e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -6.233821930490681 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.987683755262493e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.2724287 0.1481136 1.4368664 ] [ 0.4789501 2.1479286 0.1817905 ] [ 0.4960997 2.2282813 2.5504119 ] [ 2.2599791 0.584779 0.2219248 ] [ 2.2771322 0.6651331 2.5905463 ] [ 2.483652 2.6649473 1.3354731 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.724287e-11 1.481136e-11 1.4368664e-10 ] [ 4.789501e-11 2.1479286e-10 1.817905e-11 ] [ 4.960997e-11 2.2282813e-10 2.5504119e-10 ] [ 2.2599791e-10 5.84779e-11 2.219248e-11 ] [ 2.2771322e-10 6.651331000000001e-11 2.5905463e-10 ] [ 2.483652e-10 2.6649473e-10 1.3354731e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.9e-06 5e-07 -6.2e-06 ] [ -2.7e-06 -2.7e-06 8e-06 ] [ 5e-07 8.8e-06 6.9e-06 ] [ 9.4e-06 -4.8e-06 -1.4e-06 ] [ -6.9e-06 -1.6e-06 -3e-06 ] [ -3.1e-06 -3e-07 -4.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.646312200320001e-15 8.010883104e-16 -9.93349504896e-15 ] [ -4.32587687616e-15 -4.32587687616e-15 1.28174129664e-14 ] [ 8.010883104e-16 1.409915426304e-14 1.105501868352e-14 ] [ 1.506046023552e-14 -7.69044777984e-15 -2.24304726912e-15 ] [ -1.105501868352e-14 -2.56348259328e-15 -4.8065298624e-15 ] [ -4.96674752448e-15 -4.8065298624e-16 -7.04957713152e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.32264193049068 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.333434232432195e-18 } }