{ "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" [ [ -0.3271217 0.3928946 -10.0213585 ] [ -9.8481851 -1.8918665 3.8119425 ] [ -3.1933549 1.6782228 2.6674809 ] [ 0.147583 -9.130069 1.209421 ] [ 7.6874027 7.1394407 -6.8710284 ] [ 2.650497 -0.7031919 5.3871189 ] [ 2.883179 2.5145693 3.8164236 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.241067398963514e-10 6.294865425585677e-10 -1.605598629735536e-08 ] [ -1.577853192453091e-08 -3.031104275974723e-09 6.107405153333903e-09 ] [ -5.116318562697122e-09 2.688809334653514e-09 4.273775534410543e-09 ] [ 2.364540322275264e-10 -1.462798309809084e-08 1.937706050904557e-09 ] [ 1.23165768806148e-08 1.143864497512799e-08 -1.100860106333283e-08 ] [ 4.246564326900538e-09 -1.126637622115932e-09 8.631115955049813e-09 ] [ 4.619361987381524e-09 4.028784143841421e-09 6.11458466698937e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.115787 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.941163067399257e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6540358 2.4343514 0.5664705 ] [ 1.4030878 1.1029049 4.1418867 ] [ 1.9465905 3.2035854 2.8598625 ] [ 4.8964747 -0.1777552 2.6327778 ] [ 4.9445563 2.1045454 1.5647666 ] [ 3.8710121 0.9619255 4.6331281 ] [ 4.2508339 3.1577175 3.6489708 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6540358e-10 2.4343514e-10 5.664705e-11 ] [ 1.4030878e-10 1.1029049e-10 4.1418867e-10 ] [ 1.9465905e-10 3.2035854e-10 2.8598625e-10 ] [ 4.8964747e-10 -1.777552e-11 2.6327778e-10 ] [ 4.9445563e-10 2.1045454e-10 1.5647666e-10 ] [ 3.871012100000001e-10 9.619255e-11 4.6331281e-10 ] [ 4.2508339e-10 3.1577175e-10 3.6489708e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.9e-06 -8.1e-06 1.56e-05 ] [ 9e-06 -1.9e-06 -6.9e-06 ] [ -3.8e-06 2.08e-05 -1.31e-05 ] [ -1.32e-05 2.54e-05 -3.8e-06 ] [ 4.3e-06 -7.4e-06 -1.89e-05 ] [ 1.33e-05 -1.15e-05 2.23e-05 ] [ -1.74e-05 -1.74e-05 4.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.265719530432e-14 -1.297763062848e-14 2.499395528448e-14 ] [ 1.44195895872e-14 -3.04413557952e-15 -1.105501868352e-14 ] [ -6.08827115904e-15 3.332527371264e-14 -2.098851373248e-14 ] [ -2.114873139456e-14 4.069528616832e-14 -6.08827115904e-15 ] [ 6.889359469440001e-15 -1.185610699392e-14 -3.028113813312e-14 ] [ 2.130894905664e-14 -1.84250311392e-14 3.572853864384e-14 ] [ -2.787787320192e-14 -2.787787320192e-14 7.69044777984e-15 ] ] } "relaxed-potential-energy" { "source-value" -20.894908 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.347733309136689e-18 } }