{ "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" [ [ 0.4190739 -1.8892498 -1.0593494 ] [ -8.5131183 1.3775208 -2.1440089 ] [ 0.3274485 -0.9059653 -0.9033867 ] [ 4.5013791 4.042301 -2.8548217 ] [ 3.2652167 -2.6246066 6.9615667 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.714304049674771e-10 -3.026911860411076e-09 -1.697264841938508e-09 ] [ -1.363951911036464e-08 2.207031620425713e-09 -3.435080934367126e-09 ] [ 5.246303312160288e-10 -1.451516422916058e-09 -1.447385050281663e-09 ] [ 7.212004355377746e-09 6.476480156436462e-09 -4.573928584292512e-09 ] [ 5.231453858585728e-09 -4.205083333317377e-09 1.115365941087981e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -8.0875561 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.295769330282843e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.1735151 1.9886322 1.5452208 ] [ 2.6431337 3.9843394 2.8745526 ] [ 5.4876167 2.1527898 2.3509896 ] [ 5.0676321 4.6754113 2.4368265 ] [ 4.4672323 3.1619222 4.4694454 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.1735151e-10 1.9886322e-10 1.5452208e-10 ] [ 2.6431337e-10 3.9843394e-10 2.8745526e-10 ] [ 5.487616700000001e-10 2.1527898e-10 2.3509896e-10 ] [ 5.0676321e-10 4.675411300000001e-10 2.4368265e-10 ] [ 4.4672323e-10 3.1619222e-10 4.4694454e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.2e-05 6.3e-06 -5.5e-06 ] [ 1.3e-06 -8e-07 9.3e-06 ] [ -6.8e-06 -8.9e-06 3.3e-06 ] [ -6e-06 8e-07 -7e-06 ] [ -5e-07 2.6e-06 -1e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.92261194496e-14 1.009371271104e-14 -8.8119714144e-15 ] [ 2.08282960704e-15 -1.28174129664e-15 1.490024257344e-14 ] [ -1.089480102144e-14 -1.425937192512e-14 5.28718284864e-15 ] [ -9.6130597248e-15 1.28174129664e-15 -1.12152363456e-14 ] [ -8.010883104e-16 4.16565921408e-15 -1.6021766208e-16 ] ] } "relaxed-potential-energy" { "source-value" -10.977047 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.758716806882278e-18 } }