{ "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" [ [ 0.0409622 2.87289 0.6143003 ] [ 0.4467191 2.12103 2.019138 ] [ 1.9155 0.4332474 1.113336 ] [ 2.832667 2.287938 0.2396185 ] [ 2.613397 2.701371 2.225579 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.09622e-12 2.87289e-10 6.143003e-11 ] [ 4.467191e-11 2.12103e-10 2.019138e-10 ] [ 1.9155e-10 4.332474e-11 1.113336e-10 ] [ 2.832667e-10 2.287938e-10 2.396185e-11 ] [ 2.613397e-10 2.701371e-10 2.225579e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.6605713 16.6829313 -31.8326101 ] [ 6.7553838 -17.5735211 32.5529404 ] [ -2.1363873 -6.6266566 -3.8385534 ] [ -0.813385 0.7405514 4.1308267 ] [ 3.8549597 6.776695 -1.0126036 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.227358823883146e-08 2.672900249527255e-08 -5.100146368126196e-08 ] [ 1.082331798889106e-08 -2.81558846515555e-08 5.21555600471758e-08 ] [ -3.422869785034036e-09 -1.061707427859002e-08 -6.15004051517235e-09 ] [ -1.303186430709408e-09 1.186494139580709e-09 6.618313963316415e-09 ] [ 6.176326305466182e-09 1.085746229529226e-08 -1.622369814057915e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -2.7667198 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.432773779864452e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.1613411 2.8752099 0.4333367 ] [ 0.4476918 2.057931 2.152535 ] [ 1.7727018 0.0643171 1.0196849 ] [ 2.6550984 2.4760403 0.3727767 ] [ 2.8124121 2.9429782 2.2336385 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.613411e-11 2.8752099e-10 4.333367000000001e-11 ] [ 4.476918e-11 2.057931e-10 2.152535e-10 ] [ 1.7727018e-10 6.431710000000001e-12 1.0196849e-10 ] [ 2.6550984e-10 2.4760403e-10 3.727767000000001e-11 ] [ 2.8124121e-10 2.9429782e-10 2.2336385e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.65e-05 4.14e-05 -5.84e-05 ] [ -6.2e-06 -5.47e-05 7.15e-05 ] [ 3.6e-06 1.89e-05 -4e-06 ] [ -2.36e-05 -2.81e-05 -1.47e-05 ] [ -4e-07 2.24e-05 5.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.24576804512e-14 6.633011210111999e-14 -9.356711465472001e-14 ] [ -9.93349504896e-15 -8.763906115775999e-14 1.145556283872e-13 ] [ 5.76783583488e-15 3.028113813312e-14 -6.4087064832e-15 ] [ -3.781136825088e-14 -4.502116304448e-14 -2.355199632576e-14 ] [ -6.408706483200001e-16 3.588875630592e-14 8.8119714144e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.088346 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.77654887245412e-18 } }