{ "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" [ [ 3.034718 3.53714 2.04977 ] [ 2.090115 3.249613 4.258758 ] [ 4.260617 1.92046 3.281861 ] [ 5.152468 4.155846 3.194292 ] [ 3.505339 5.178097 3.977293 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.034718e-10 3.53714e-10 2.04977e-10 ] [ 2.090115e-10 3.249613e-10 4.258758e-10 ] [ 4.260617e-10 1.92046e-10 3.281861e-10 ] [ 5.152468e-10 4.155846e-10 3.194292e-10 ] [ 3.505339e-10 5.178097e-10 3.977293e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.6896813 -0.4674503 -3.3936661 ] [ -0.5576348 -0.806047 0.7160173 ] [ 0.1825598 -1.6072861 0.8570172 ] [ 6.2021887 -1.963176 -1.8908202 ] [ -4.1374324 4.8439594 3.7114518 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.707167897766744e-09 -7.4893794821629e-10 -5.437252529017907e-09 ] [ -8.934294468652631e-10 -1.291429669305798e-09 1.147186187599768e-09 ] [ 2.924930458677131e-10 -2.575156233572987e-09 1.373092932776105e-09 ] [ 9.937001814798834e-09 -3.145354715629584e-09 -3.029427943535207e-09 ] [ -6.628897516034541e-09 7.76087856672466e-09 5.94640135217724e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.3041336 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.33046888195343e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.0749883 3.1975829 1.6553681 ] [ 2.261078 3.3972398 4.0198622 ] [ 4.1965005 1.886472 3.5052151 ] [ 4.9460186 4.2213006 2.9761233 ] [ 3.5646715 5.3385607 4.6054054 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.0749883e-10 3.1975829e-10 1.6553681e-10 ] [ 2.261078e-10 3.3972398e-10 4.0198622e-10 ] [ 4.1965005e-10 1.886472e-10 3.5052151e-10 ] [ 4.9460186e-10 4.2213006e-10 2.9761233e-10 ] [ 3.5646715e-10 5.3385607e-10 4.605405400000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.14e-05 -6.5e-06 2.91e-05 ] [ 1.68e-05 3.22e-05 -3.17e-05 ] [ 4e-07 -2.08e-05 8.4e-06 ] [ -5.64e-05 2.54e-05 -1.01e-05 ] [ 1.78e-05 -3.04e-05 4.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.42865799676e-14 -1.0414148121e-14 4.66233400494e-14 ] [ 2.691656745119999e-14 5.159008761479998e-14 -5.078899929779999e-14 ] [ 6.408706536e-16 -3.332527398719999e-14 1.34582837256e-14 ] [ -9.03627621576e-14 4.06952865036e-14 -1.61819840034e-14 ] [ 2.851874408519999e-14 -4.870616967359999e-14 6.8893595262e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.674822 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.710295038050915e-18 } }