{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.5577694 2.945013 2.286605 ] [ 2.630246 0.191498 2.174801 ] [ 2.389079 2.171655 0.2590592 ] [ 2.979224 2.829603 2.740156 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.577694e-11 2.945013e-10 2.286605e-10 ] [ 2.630246e-10 1.91498e-11 2.174801e-10 ] [ 2.389079e-10 2.171655e-10 2.590592e-11 ] [ 2.979224e-10 2.829603e-10 2.740156e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.1116507 1.0015403 0.9093122 ] [ 0.438854 -1.1065051 0.2218988 ] [ 0.3350847 -0.7068123 -3.655968 ] [ 1.337712 0.811777 2.524757 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.383237382835955e-09 1.604644453449018e-09 1.456878747848214e-09 ] [ 7.031216187445633e-10 -1.772816602015966e-09 3.555210695435751e-10 ] [ 5.368648723277818e-10 -1.132438142353876e-09 -5.857506455992934e-09 ] [ 2.14325089176361e-09 1.300610130703162e-09 4.045106638601146e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.3987894 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.04763753650286e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.038955 3.3615674 1.8643712 ] [ 3.239201 0.7073149 1.865941 ] [ 1.7034086 1.6723292 0.2370881 ] [ 2.5747537 2.3965576 3.493221 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.038955e-10 3.3615674e-10 1.8643712e-10 ] [ 3.239201e-10 7.073149e-11 1.865941e-10 ] [ 1.7034086e-10 1.6723292e-10 2.370881e-11 ] [ 2.5747537e-10 2.3965576e-10 3.493221e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.1e-06 3.5e-06 -2.2e-06 ] [ 6e-06 -1.4e-06 -2.6e-06 ] [ -2.4e-06 1e-07 8.1e-06 ] [ -5.7e-06 -2.1e-06 -3.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.36457090368e-15 5.6076181728e-15 -3.52478856576e-15 ] [ 9.6130597248e-15 -2.24304726912e-15 -4.16565921408e-15 ] [ -3.84522388992e-15 1.6021766208e-16 1.297763062848e-14 ] [ -9.13240673856e-15 -3.36457090368e-15 -5.28718284864e-15 ] ] } "relaxed-potential-energy" { "source-value" -7.5906962 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.21616359872354e-18 } }