{ "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" [ [ 0.1501776 0.7389508 1.254214 ] [ 0.5251994 1.126951 2.894489 ] [ 1.795844 1.050789 0.3566565 ] [ 2.560887 2.159455 0.963327 ] [ 1.607121 2.890729 1.590789 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.501776e-11 7.389508e-11 1.254214e-10 ] [ 5.251994e-11 1.126951e-10 2.894489e-10 ] [ 1.795844e-10 1.050789e-10 3.566565e-11 ] [ 2.560887e-10 2.159455e-10 9.633270000000001e-11 ] [ 1.607121e-10 2.890729e-10 1.590789e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -17.269491 -9.4001154 -18.4394392 ] [ 4.0423711 5.4763886 25.82707 ] [ -24.7106532 -57.0935296 -39.9362741 ] [ 114.0675968 -5.1520291 -22.4161954 ] [ -76.1298237 66.1692855 54.9648388 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.766877473331601e-08 -1.506064512670204e-08 -2.954323838690305e-08 ] [ 6.47659246901758e-09 8.774141781335644e-09 4.137952773776506e-08 ] [ -3.959083084173671e-08 -9.147391832407278e-08 -6.398496468488056e-08 ] [ 1.827564367838009e-07 -8.254460573701265e-09 -3.59147041971645e-08 ] [ -1.219734236777657e-07 1.060148822431404e-07 8.806337969140073e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 38.158515 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.113668061744612e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.0695135 0.1426813 1.2165625 ] [ 0.0711147 1.6929376 2.8736713 ] [ 1.8068787 0.5972394 -0.1706119 ] [ 2.8822354 2.4284225 0.6291877 ] [ 1.8094867 3.1055939 2.5106659 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.951350000000001e-12 1.426813e-11 1.2165625e-10 ] [ 7.111470000000001e-12 1.6929376e-10 2.8736713e-10 ] [ 1.8068787e-10 5.972394e-11 -1.706119e-11 ] [ 2.8822354e-10 2.4284225e-10 6.291877e-11 ] [ 1.8094867e-10 3.1055939e-10 2.5106659e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.4e-06 -1.82e-05 -2.09e-05 ] [ -4e-06 3.7e-06 1.58e-05 ] [ -2.51e-05 -1.19e-05 1.49e-05 ] [ 3.3e-05 2.88e-05 -5e-07 ] [ -5e-07 -2.4e-06 -9.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.44740051072e-15 -2.915961449856e-14 -3.348549137472e-14 ] [ -6.4087064832e-15 5.928053496960001e-15 2.531439060864e-14 ] [ -4.021463318208e-14 -1.906590178752e-14 2.387243164992e-14 ] [ 5.28718284864e-14 4.614268667904e-14 -8.010883104e-16 ] [ -8.010883104e-16 -3.84522388992e-15 -1.490024257344e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.066442 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.41391011310392e-18 } }