{ "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" [ [ 0.6025016 -1.2611536 -2.5584571 ] [ -2.8655122 -1.3889944 0.0343945 ] [ -2.387638 1.4827813 0.9632831 ] [ -1.1519211 -3.760229 -0.1689668 ] [ 2.2294251 3.1015047 -1.7005561 ] [ 1.0984926 0.4317601 1.6910202 ] [ 2.4746521 1.3943311 1.7392822 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.653139775145932e-10 -2.020590813157755e-09 -4.099100150939768e-09 ] [ -4.591056653457174e-09 -2.225414354102124e-09 5.51060637841056e-11 ] [ -3.825417782533671e-09 2.375677532619431e-09 1.543349662031748e-09 ] [ -1.845581055426219e-09 -6.024550992654163e-09 -2.707146566513894e-10 ] [ 3.571932773044702e-09 4.969158319641318e-09 -2.724591225778827e-09 ] [ 1.759979161841806e-09 6.9175593801427e-10 2.70931302974054e-09 ] [ 3.964829739233625e-09 2.233964690074347e-09 2.78663727781359e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -20.667806 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.311347557642996e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.914001 1.9633567 0.8947682 ] [ 1.8797448 0.8719384 3.7916464 ] [ 2.0116221 3.001048 2.8022206 ] [ 3.8018148 0.2805379 2.4163994 ] [ 5.0998892 2.2415123 1.7799991 ] [ 4.0656354 1.1501171 4.6768611 ] [ 4.1938837 3.2787645 3.6859682 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.914001e-10 1.9633567e-10 8.947682000000001e-11 ] [ 1.8797448e-10 8.719384e-11 3.7916464e-10 ] [ 2.0116221e-10 3.001048e-10 2.8022206e-10 ] [ 3.8018148e-10 2.805379e-11 2.4163994e-10 ] [ 5.0998892e-10 2.2415123e-10 1.7799991e-10 ] [ 4.0656354e-10 1.1501171e-10 4.6768611e-10 ] [ 4.1938837e-10 3.2787645e-10 3.6859682e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.06e-05 -2e-05 3.73e-05 ] [ -1.72e-05 2.15e-05 6.6e-06 ] [ 5.5e-06 6.1e-06 -8e-06 ] [ 2.23e-05 -9e-06 -5.2e-06 ] [ -5.8e-06 2.19e-05 -2.43e-05 ] [ -1.09e-05 -2.03e-05 -1.12e-05 ] [ -4.4e-06 -3e-07 4.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.698307218048e-14 -3.2043532416e-14 5.976118795584e-14 ] [ -2.755743787776e-14 3.44467973472e-14 1.057436569728e-14 ] [ 8.8119714144e-15 9.77327738688e-15 -1.28174129664e-14 ] [ 3.572853864384e-14 -1.44195895872e-14 -8.33131842816e-15 ] [ -9.292624400640001e-15 3.508766799552e-14 -3.893289188544e-14 ] [ -1.746372516672e-14 -3.252418540224e-14 -1.794437815296e-14 ] [ -7.04957713152e-15 -4.8065298624e-16 7.69044777984e-15 ] ] } "relaxed-potential-energy" { "source-value" -22.906204 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.669978452007545e-18 } }