{ "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" [ [ 2.860772 3.213277 0.634813 ] [ 3.47304 1.055338 1.294101 ] [ 4.886118 2.711251 1.984131 ] [ 3.680898 4.652345 1.961095 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.860772e-10 3.213277e-10 6.34813e-11 ] [ 3.47304e-10 1.055338e-10 1.294101e-10 ] [ 4.886118e-10 2.711251e-10 1.984131e-10 ] [ 3.680898e-10 4.652345e-10 1.961095e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -15.702768 3.5377055 -12.0753588 ] [ -1.2292573 -6.0823705 -0.3683169 ] [ 17.4462711 -4.3218327 10.0132961 ] [ -0.5142458 6.8664977 2.4303796 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.515860797872291e-08 5.668029090073287e-09 -1.934685771652628e-08 ] [ -1.969487323233928e-09 -9.745031894430895e-09 -5.901087310873145e-10 ] [ 2.795200790684947e-08 -6.924339367997131e-09 1.604306904074333e-08 ] [ -8.23912604892637e-10 1.100134217235474e-08 3.893897406870266e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.0738556 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.453791942261005e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6225475 3.1355151 0.7184934 ] [ 3.5889218 0.9719538 1.0817343 ] [ 4.8279503 2.6806067 2.2184556 ] [ 3.8614084 4.8441354 1.8554566 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6225475e-10 3.1355151e-10 7.184934e-11 ] [ 3.5889218e-10 9.719538e-11 1.0817343e-10 ] [ 4.8279503e-10 2.6806067e-10 2.2184556e-10 ] [ 3.8614084e-10 4.8441354e-10 1.8554566e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0001677 2.5e-06 0.0001701 ] [ 2.77e-05 3.39e-05 -2.57e-05 ] [ -0.0001981 4.88e-05 -8.31e-05 ] [ 2.7e-06 -8.53e-05 -6.13e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.686850215218e-13 4.005441585e-15 2.725302454434e-13 ] [ 4.438029276179999e-14 5.431378789259999e-14 -4.11759394938e-14 ] [ -3.173911911954e-13 7.818621973919999e-14 -1.331408782854e-13 ] [ 4.3258769118e-15 -1.366656668802e-13 -9.821342766419999e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.092646 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.937455486443356e-18 } }