{ "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" [ [ 0.9136055 0.1992462 0.0711002 ] [ 0.7203108 0.3740979 2.589381 ] [ 1.027468 2.872573 2.429267 ] [ 2.566191 2.896163 0.5924317 ] [ 2.633567 2.125326 2.686178 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.136055e-11 1.992462e-11 7.11002e-12 ] [ 7.203108000000001e-11 3.740979e-11 2.589381e-10 ] [ 1.027468e-10 2.872573e-10 2.429267e-10 ] [ 2.566191e-10 2.896163e-10 5.924317e-11 ] [ 2.633567e-10 2.125326e-10 2.686178e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2587213 -0.2654487 1.1552621 ] [ 0.2853743 0.0424638 -1.2034505 ] [ -21.4002214 9.6521739 -2.1637991 ] [ 0.9888017 1.535482 -4.2422685 ] [ 20.3847668 -10.9646709 6.454256 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.14517218162983e-10 -4.252957011617529e-10 1.850933927516312e-09 ] [ 4.572200316371655e-10 6.803450759032704e-11 -1.928140255390071e-09 ] [ -3.428693440702385e-08 1.546448736247596e-08 -3.466788330128081e-09 ] [ 1.584234966347295e-09 2.460113362059225e-09 -6.796863409856285e-09 ] [ 3.265999678742003e-08 -1.756733937074609e-08 1.034085806785812e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -3.1973783 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.122764760113248e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.195112 -1.0632331 0.6289696 ] [ 0.8557779 0.5716213 2.0981928 ] [ 0.772172 3.0339445 1.7247034 ] [ 2.9772343 4.1936991 1.7714995 ] [ 3.060846 1.7313744 2.1449926 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.95112e-11 -1.0632331e-10 6.289696e-11 ] [ 8.557779000000001e-11 5.716213e-11 2.0981928e-10 ] [ 7.72172e-11 3.0339445e-10 1.7247034e-10 ] [ 2.9772343e-10 4.1936991e-10 1.7714995e-10 ] [ 3.060846e-10 1.7313744e-10 2.1449926e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.5e-06 -1.51e-05 1.08e-05 ] [ -9.4e-06 -1.16e-05 -2.2e-05 ] [ 1.17e-05 4e-06 1.63e-05 ] [ 1.91e-05 1.82e-05 -7e-07 ] [ -2.69e-05 4.4e-06 -4.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.8119714144e-15 -2.419286697408e-14 1.730350750464e-14 ] [ -1.506046023552e-14 -1.858524880128e-14 -3.52478856576e-14 ] [ 1.874546646336e-14 6.4087064832e-15 2.611547891904e-14 ] [ 3.060157345728e-14 2.915961449856e-14 -1.12152363456e-15 ] [ -4.309855109952001e-14 7.04957713152e-15 -7.2097947936e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.268346 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.64517038954852e-18 } }