{ "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" [ [ 2.420109 0.1444118 2.696301 ] [ 1.741529 2.490211 2.002098 ] [ 2.88298 4.123868 0.919121 ] [ 3.624829 1.629307 1.356835 ] [ 3.547112 2.169997 3.636924 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.420109e-10 1.444118e-11 2.696301e-10 ] [ 1.741529e-10 2.490211e-10 2.002098e-10 ] [ 2.88298e-10 4.123868e-10 9.19121e-11 ] [ 3.624829e-10 1.629307e-10 1.356835e-10 ] [ 3.547112e-10 2.169997e-10 3.636924e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.8853095 -15.3902012 2.2569204 ] [ -12.8129339 7.3735666 -3.4814227 ] [ 1.4197126 -0.1056965 -0.8296437 ] [ 8.0555143 1.4117415 -12.5721696 ] [ 8.2230165 6.7105896 14.6263157 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.827128666272137e-09 -2.465782055204811e-08 3.615985099886584e-09 ] [ -2.052858313843576e-08 1.181375601843175e-08 -5.577854057062412e-09 ] [ 2.274630335975182e-09 -1.693444612003872e-10 -1.329235739734009e-09 ] [ 1.290635667998008e-08 2.261859225913123e-09 -2.014283620585249e-08 ] [ 1.317472478875264e-08 1.075154976890362e-08 2.343394106297998e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -12.68516 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.032386678310733e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3099203 0.2641695 2.3719769 ] [ 1.6707743 2.7110103 2.4041988 ] [ 2.7099818 3.7236711 0.4793975 ] [ 3.9827701 1.9121438 1.4326544 ] [ 3.5431124 1.9468001 3.9230514 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3099203e-10 2.641695e-11 2.3719769e-10 ] [ 1.6707743e-10 2.7110103e-10 2.4041988e-10 ] [ 2.7099818e-10 3.7236711e-10 4.793975e-11 ] [ 3.9827701e-10 1.9121438e-10 1.4326544e-10 ] [ 3.5431124e-10 1.9468001e-10 3.9230514e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2e-06 5.9e-05 -3.7e-05 ] [ 3.7e-05 -6.33e-05 5.69e-05 ] [ 2.76e-05 -4.37e-05 2.98e-05 ] [ -3.3e-05 -8e-07 4.44e-05 ] [ -2.97e-05 4.88e-05 -9.4e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.2043532416e-15 9.45284206272e-14 -5.92805349696e-14 ] [ 5.92805349696e-14 -1.0141778009664e-13 9.116384972352e-14 ] [ 4.422007473408001e-14 -7.001511832895999e-14 4.774486329984001e-14 ] [ -5.28718284864e-14 -1.28174129664e-15 7.113664196352e-14 ] [ -4.758464563776e-14 7.818621909504e-14 -1.506046023552e-13 ] ] } "relaxed-potential-energy" { "source-value" -16.808942 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.693089389278319e-18 } }