{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.915912 1.360436 2.810198 ] [ 1.265862 2.897087 3.881297 ] [ 2.470833 3.120785 1.738737 ] [ 4.740838 1.736953 1.131717 ] [ 4.024671 3.068015 3.686077 ] [ 4.392743 4.331921 1.580851 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.915912e-10 1.360436e-10 2.810198e-10 ] [ 1.265862e-10 2.897087e-10 3.881297e-10 ] [ 2.470833e-10 3.120785e-10 1.738737e-10 ] [ 4.740838000000001e-10 1.736953e-10 1.131717e-10 ] [ 4.024671e-10 3.068015e-10 3.686077e-10 ] [ 4.392743000000001e-10 4.331921e-10 1.580851e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.9950934 -8.5542172 1.0536594 ] [ -6.3307567 1.4366517 3.3068824 ] [ -14.1051857 5.8692151 -12.7090876 ] [ 2.8075534 -4.2261109 -2.5800419 ] [ 9.6349226 1.5141817 12.1927654 ] [ 3.998373 3.9602797 -1.2641776 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.400845296127615e-09 -1.37053669200009e-08 1.688148470874459e-09 ] [ -1.014299046027895e-08 2.301769784936378e-09 5.298209712665841e-09 ] [ -2.259899894677093e-08 9.403519293139971e-09 -2.036220319217914e-08 ] [ 4.498196456187255e-09 -6.770976136672711e-09 -4.133682846920964e-09 ] [ 1.543684786011853e-08 2.425986539370397e-09 1.953496382772366e-08 ] [ 6.406099794616481e-09 6.345067599444529e-09 -2.025435811946198e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.8209162 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.253048919211207e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.42879 1.0803859 2.6540653 ] [ 0.7053009 3.6898994 3.699014 ] [ 1.9254954 2.8632094 1.8051044 ] [ 5.0987674 1.8645447 0.8060956 ] [ 4.5587818 2.9468229 4.0873099 ] [ 4.0937235 4.0703346 1.7772878 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.42879e-10 1.0803859e-10 2.6540653e-10 ] [ 7.053009e-11 3.6898994e-10 3.699014e-10 ] [ 1.9254954e-10 2.8632094e-10 1.8051044e-10 ] [ 5.0987674e-10 1.8645447e-10 8.060956000000001e-11 ] [ 4.5587818e-10 2.9468229e-10 4.0873099e-10 ] [ 4.0937235e-10 4.0703346e-10 1.7772878e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.5e-06 -3.8e-06 3.1e-06 ] [ 2.95e-05 1.12e-05 0.0 ] [ -2.89e-05 -7.2e-06 -2.17e-05 ] [ 6.3e-06 1.02e-05 1.76e-05 ] [ -1.2e-06 -3.7e-06 -1.9e-05 ] [ -1.32e-05 -6.6e-06 2e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.2016324755e-14 -6.088271209199999e-15 4.9667475654e-15 ] [ 4.726421070299999e-14 1.79443783008e-14 0.0 ] [ -4.63029047226e-14 -1.15356717648e-14 -3.476723295779999e-14 ] [ 1.00937127942e-14 1.63422016668e-14 2.81983087584e-14 ] [ -1.9226119608e-15 -5.9280535458e-15 -3.0441356046e-14 ] [ -2.11487315688e-14 -1.05743657844e-14 3.204353268e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.656156 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.66861039554589e-18 } }