{ "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" [ [ 3.032432 2.348999 1.593337 ] [ 4.810482 1.062628 3.508091 ] [ 5.121871 3.223017 1.668157 ] [ 3.284691 4.649431 1.699114 ] [ 3.943916 3.285754 3.641374 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.032432e-10 2.348999e-10 1.593337e-10 ] [ 4.810482000000001e-10 1.062628e-10 3.508091e-10 ] [ 5.121871e-10 3.223017e-10 1.668157e-10 ] [ 3.284691e-10 4.649431e-10 1.699114e-10 ] [ 3.943916e-10 3.285754e-10 3.641374e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.4703019 -3.0265876 1.3628389 ] [ -1.2097938 2.7150131 -3.4421877 ] [ 3.2012901 -1.722747 0.1722492 ] [ -0.5706585 1.4123513 0.0938155 ] [ -0.9505359 0.6219702 1.8132841 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.535067088978196e-10 -4.849127893523182e-09 2.183508623496789e-09 ] [ -1.938303342348791e-09 4.349930513985733e-09 -5.514992657345324e-09 ] [ 5.129032154618494e-09 -2.760144966953338e-09 2.759736411915033e-10 ] [ -9.142957071607967e-10 2.262836233216487e-09 1.503090007686624e-10 ] [ -1.522926396211087e-09 9.965061132743003e-10 2.905201391888369e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.18997 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.593919142545338e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.0078553 2.1958183 1.7701001 ] [ 4.743162 1.237441 3.1549351 ] [ 5.2693309 3.1421857 1.7611536 ] [ 3.3341975 4.5904939 1.6890995 ] [ 3.8388462 3.4038901 3.7347847 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.0078553e-10 2.1958183e-10 1.7701001e-10 ] [ 4.743162e-10 1.237441e-10 3.1549351e-10 ] [ 5.2693309e-10 3.1421857e-10 1.7611536e-10 ] [ 3.3341975e-10 4.590493900000001e-10 1.6890995e-10 ] [ 3.8388462e-10 3.4038901e-10 3.7347847e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.66e-05 -9.4e-06 1.93e-05 ] [ -1.61e-05 7.7e-06 -3.64e-05 ] [ -2.46e-05 3e-06 4.38e-05 ] [ 6.1e-06 -1.86e-05 1.8e-06 ] [ 1.8e-05 1.73e-05 -2.85e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.659613190528e-14 -1.506046023552e-14 3.092200878144e-14 ] [ -2.579504359488e-14 1.233675998016e-14 -5.831922899712e-14 ] [ -3.941354487168e-14 4.8065298624e-15 7.017533599104001e-14 ] [ 9.77327738688e-15 -2.980048514688e-14 2.88391791744e-15 ] [ 2.88391791744e-14 2.771765553984e-14 -4.56620336928e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.096417 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.899365623764767e-18 } }