{ "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" [ [ 2.990348 2.100415 1.411886 ] [ 2.946969 3.752547 2.888488 ] [ 5.496135 2.06422 2.457996 ] [ 4.937229 4.674633 2.559339 ] [ 4.468449 3.37128 4.359326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.990348e-10 2.100415e-10 1.411886e-10 ] [ 2.946969e-10 3.752547e-10 2.888488e-10 ] [ 5.496135e-10 2.06422e-10 2.457996e-10 ] [ 4.937229e-10 4.674633e-10 2.559339e-10 ] [ 4.468449e-10 3.37128e-10 4.359326000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.8880623 -7.7060727 -8.8740754 ] [ -14.7279477 5.449984 0.9885737 ] [ 9.5559254 -8.8391004 -2.8758143 ] [ 8.241598 13.0225331 -5.6398568 ] [ 2.8184866 -1.927344 16.4011728 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.433715758873874e-09 -1.234648951812513e-08 -1.421783613709641e-08 ] [ -2.359677347730513e-08 8.731836948534066e-09 1.583869670077753e-09 ] [ 1.531028026598889e-08 -1.416180000978393e-08 -4.607562437222318e-09 ] [ 1.320449563363204e-08 2.086439807641415e-08 -9.036046709619901e-09 ] [ 4.515713336558081e-09 -3.087945497039155e-09 2.627757561386088e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 45.480283 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.28674461299677e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1757986 0.9138313 -0.0268136 ] [ 0.8234647 4.8674591 3.292287 ] [ 7.0828144 0.8416974 2.1185258 ] [ 5.9229286 6.2008353 1.8237886 ] [ 4.8341236 3.1392718 6.4692472 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1757986e-10 9.138313000000001e-11 -2.68136e-12 ] [ 8.234647000000001e-11 4.8674591e-10 3.292287e-10 ] [ 7.082814400000001e-10 8.416974000000001e-11 2.1185258e-10 ] [ 5.9229286e-10 6.2008353e-10 1.8237886e-10 ] [ 4.8341236e-10 3.1392718e-10 6.4692472e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0439999 -0.0585563 -0.0780875 ] [ -0.0683472 0.0715711 0.0253694 ] [ 0.0832458 -0.0234031 -0.0065014 ] [ 0.0115621 0.0073007 -0.0038045 ] [ 0.0175392 0.0030876 0.063024 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.049561109753793e-11 -9.381753486055103e-11 -1.2510996687672e-10 ] [ -1.095042859371418e-10 1.146695431449389e-10 4.064625956372352e-11 ] [ 1.333744745397926e-10 -3.749589967424448e-11 -1.041639108246912e-11 ] [ 1.852452630735168e-11 1.169701085547456e-11 -6.0954809538336e-12 ] [ 2.810089618753536e-11 4.94688053438208e-12 1.009755793492992e-10 ] ] } "relaxed-potential-energy" { "source-value" 0.015952917 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.555939065096288e-21 } }