{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.743488 1.903222 1.191758 ] [ 2.092285 1.109675 3.649357 ] [ 1.94045 3.241003 2.726585 ] [ 4.050079 0.1031898 2.277213 ] [ 5.000478 2.032764 2.106801 ] [ 4.158728 1.007331 4.48257 ] [ 3.981083 3.39009 3.613579 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.743488e-10 1.903222e-10 1.191758e-10 ] [ 2.092285e-10 1.109675e-10 3.649357e-10 ] [ 1.94045e-10 3.241003e-10 2.726585e-10 ] [ 4.050079e-10 1.031898e-11 2.277213e-10 ] [ 5.000478000000001e-10 2.032764e-10 2.106801e-10 ] [ 4.158728e-10 1.007331e-10 4.48257e-10 ] [ 3.981083e-10 3.39009e-10 3.613579e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.8594808 -0.2125671 -9.441648 ] [ -7.8999964 -4.5867266 4.6635136 ] [ -3.1118418 3.4731311 0.5358188 ] [ 1.6639272 -7.2189768 -2.2460455 ] [ 6.5846099 3.5146834 -4.147022 ] [ 1.5430706 -1.5557467 6.7425098 ] [ 4.0797113 6.5862026 3.8928733 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.581393285386481e-09 -3.405700379712557e-10 -1.512718768742308e-08 ] [ -1.265718953648417e-08 -7.348746124521474e-09 7.471772460702842e-09 ] [ -4.985720179588189e-09 5.564569449393387e-09 8.584763543451111e-10 ] [ 2.665905258553206e-09 -1.15660758550576e-08 -3.598561589353047e-09 ] [ 1.054970803886823e-08 5.631143572993855e-09 -6.644261694343258e-09 ] [ 2.472271639563829e-09 -2.492580990626751e-09 1.080269156707488e-08 ] [ 6.536418064473574e-09 1.055225982557217e-08 6.237070588996545e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.5607122 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.909243081837335e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.8616841 1.7810157 0.9196596 ] [ 1.4868338 1.2632352 4.3014839 ] [ 1.9471003 3.0194624 2.7449458 ] [ 4.3236672 0.1242187 2.2396406 ] [ 5.3044411 2.5421204 1.6798538 ] [ 3.8411173 0.8725027 4.4553294 ] [ 4.2017472 3.1847197 3.7069498 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8616841e-10 1.7810157e-10 9.196596e-11 ] [ 1.4868338e-10 1.2632352e-10 4.3014839e-10 ] [ 1.9471003e-10 3.0194624e-10 2.7449458e-10 ] [ 4.3236672e-10 1.242187e-11 2.2396406e-10 ] [ 5.3044411e-10 2.5421204e-10 1.6798538e-10 ] [ 3.8411173e-10 8.725027e-11 4.4553294e-10 ] [ 4.2017472e-10 3.1847197e-10 3.7069498e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.74e-05 3.6e-06 6.2e-06 ] [ 4.1e-06 5.8e-06 5.5e-06 ] [ 1.77e-05 -1.94e-05 6.6e-06 ] [ -6.5e-06 4.7e-06 4.8e-06 ] [ -1.06e-05 2.9e-06 -9.6e-06 ] [ -1.54e-05 5e-07 -1.24e-05 ] [ -6.7e-06 2e-06 -1.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.787787320192e-14 5.76783583488e-15 9.93349504896e-15 ] [ 6.568924145279999e-15 9.292624400640001e-15 8.8119714144e-15 ] [ 2.835852618816e-14 -3.108222644352e-14 1.057436569728e-14 ] [ -1.04141480352e-14 7.53023011776e-15 7.69044777984e-15 ] [ -1.698307218048e-14 4.646312200320001e-15 -1.538089555968e-14 ] [ -2.467351996032e-14 8.010883104e-16 -1.986699009792e-14 ] [ -1.073458335936e-14 3.2043532416e-15 -1.76239428288e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.819793 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.89373960072955e-18 } }