{ "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" [ [ 2.007741 0.810981 1.851579 ] [ 2.28758 2.972606 1.775704 ] [ 2.775609 2.277586 3.884458 ] [ 3.461309 1.568578 0.4572952 ] [ 4.556331 2.173826 2.191246 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.007741e-10 8.10981e-11 1.851579e-10 ] [ 2.28758e-10 2.972606e-10 1.775704e-10 ] [ 2.775609000000001e-10 2.277586e-10 3.884458e-10 ] [ 3.461309e-10 1.568578e-10 4.572952e-11 ] [ 4.556331e-10 2.173826e-10 2.191246e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.8944959 -6.5674842 2.8869817 ] [ -1.681387 6.4442451 -0.6444047 ] [ 0.2241791 -1.056608 1.4247303 ] [ 1.8603272 -1.4507155 -7.5683475 ] [ 5.4913766 2.6305626 3.9010403 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.4440236001888e-09 -1.052226972940418e-08 4.625454622525598e-09 ] [ -2.693878964111357e-09 1.032481892298899e-08 -1.03245015317978e-09 ] [ 3.591745158511494e-10 -1.692872648897472e-09 2.28266959641181e-09 ] [ 2.980572771434645e-09 -2.324302476681627e-09 -1.212582952249231e-08 ] [ 8.798155277014363e-09 4.214625931994289e-09 6.25015561695235e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.094294 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.93771952515264e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7143231 0.7896928 1.9693272 ] [ 2.3417988 3.1595254 1.6958423 ] [ 2.8557034 1.9404075 3.7777363 ] [ 3.5176825 1.3816181 0.4544836 ] [ 4.6590623 2.5323332 2.2628928 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7143231e-10 7.896928e-11 1.9693272e-10 ] [ 2.3417988e-10 3.1595254e-10 1.6958423e-10 ] [ 2.8557034e-10 1.9404075e-10 3.7777363e-10 ] [ 3.5176825e-10 1.3816181e-10 4.544836e-11 ] [ 4.659062300000001e-10 2.5323332e-10 2.2628928e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.1e-06 8.3e-06 5.2e-06 ] [ 9.1e-06 -1.57e-05 5.6e-06 ] [ -6.7e-06 3e-07 -1.24e-05 ] [ 3e-07 9.3e-06 1.02e-05 ] [ -7.8e-06 -2.3e-06 -8.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.1711008334e-15 1.32980660622e-14 8.331318496799998e-15 ] [ 1.45798073694e-14 -2.515417315379999e-14 8.972189150399999e-15 ] [ -1.07345834478e-14 4.806529901999999e-16 -1.98669902616e-14 ] [ 4.806529901999999e-16 1.49002426962e-14 1.63422016668e-14 ] [ -1.24969777452e-14 -3.685006258199999e-15 -1.3618501389e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.391586 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.305786281540152e-18 } }