{ "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" [ [ 3.1692171 -1.3005038 0.3780538 ] [ -6.7755491 0.5251107 -2.108107 ] [ -4.4654684 2.6885447 0.2040531 ] [ 4.2639678 1.9131356 -3.025818 ] [ 3.8078327 -3.8262871 4.5518181 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.077645585693241e-09 -2.083636800788209e-09 6.057089647549092e-10 ] [ -1.085562645053973e-08 8.413200938033837e-10 -3.377559777371838e-09 ] [ -7.154469130345365e-09 4.307523497804539e-09 3.269291089152653e-10 ] [ 6.831629577288384e-09 3.06518115599357e-09 -4.847894898336611e-09 ] [ 6.100820578121131e-09 -6.130387786595621e-09 7.292816602038275e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.3525855 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.178014068758721e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.0855849 1.8846932 1.4377076 ] [ 2.7969738 3.8408549 2.8165015 ] [ 5.2872011 2.2404918 2.3526956 ] [ 5.1251447 4.7361149 2.5495286 ] [ 4.5442256 3.2609403 4.5206018 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.0855849e-10 1.8846932e-10 1.4377076e-10 ] [ 2.7969738e-10 3.8408549e-10 2.816501500000001e-10 ] [ 5.2872011e-10 2.2404918e-10 2.3526956e-10 ] [ 5.1251447e-10 4.7361149e-10 2.5495286e-10 ] [ 4.5442256e-10 3.2609403e-10 4.5206018e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.36e-05 2.25e-05 -7.95e-05 ] [ 5.64e-05 -4.5e-05 4.56e-05 ] [ -1.4e-06 -1.44e-05 6.37e-05 ] [ -3.29e-05 -5.8e-06 -1.43e-05 ] [ 1.14e-05 4.27e-05 -1.56e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.383313490239999e-14 3.6048974265e-14 -1.27373042403e-13 ] [ 9.03627621576e-14 -7.209794852999999e-14 7.30592545104e-14 ] [ -2.2430472876e-15 -2.30713435296e-14 1.020586515858e-13 ] [ -5.271161125859999e-14 -9.2926244772e-15 -2.29111258662e-14 ] [ 1.82648136276e-14 6.84129422718e-14 -2.49939554904e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.674822 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.710295038050915e-18 } }