{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.061869 2.942366 1.677644 ] [ 1.882152 2.580028 5.41738 ] [ 1.143094 3.952812 3.395101 ] [ 3.99886 1.876175 2.533949 ] [ 4.004626 1.895608 4.810911 ] [ 3.218518 3.766044 3.544324 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.061869e-10 2.942366e-10 1.677644e-10 ] [ 1.882152e-10 2.580028e-10 5.41738e-10 ] [ 1.143094e-10 3.952812e-10 3.395101e-10 ] [ 3.99886e-10 1.876175e-10 2.533949e-10 ] [ 4.004626e-10 1.895608e-10 4.810911e-10 ] [ 3.218518e-10 3.766044e-10 3.544324e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.9299841 -4.7450791 -14.1741769 ] [ -5.1176761 -0.9170407 4.3055586 ] [ -14.2332373 3.3161328 4.1490082 ] [ 4.6415847 -6.4329302 -6.6514804 ] [ 3.7312029 -3.9314408 6.2812266 ] [ 15.9081099 12.710358 6.0898639 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.89870526593573e-09 -7.602454797866706e-09 -2.270953484826342e-08 ] [ -8.199421000246923e-09 -1.469261169862067e-09 6.898265328404379e-09 ] [ -2.280416004035852e-08 5.313030443628043e-09 6.647443937547491e-09 ] [ 7.436638489802982e-09 -1.030669036967827e-08 -1.065684639058943e-08 ] [ 5.97804605384116e-09 -6.298862535819249e-09 1.006363440846707e-08 ] [ 2.548760176289702e-08 2.036423842959825e-08 9.75703756443391e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.8350379 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.348761304861929e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.8090248 2.6210274 1.5081046 ] [ 1.5375637 2.155691 5.2988327 ] [ 1.4089497 3.9737788 3.5541894 ] [ 3.8163998 1.2813606 2.3488692 ] [ 3.9665274 2.2669365 4.6253926 ] [ 3.7706537 4.7142387 4.0439205 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8090248e-10 2.6210274e-10 1.5081046e-10 ] [ 1.5375637e-10 2.155691e-10 5.2988327e-10 ] [ 1.4089497e-10 3.9737788e-10 3.5541894e-10 ] [ 3.8163998e-10 1.2813606e-10 2.3488692e-10 ] [ 3.9665274e-10 2.2669365e-10 4.6253926e-10 ] [ 3.7706537e-10 4.7142387e-10 4.0439205e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.9e-06 3.1e-06 -3.4e-06 ] [ -7.6e-06 -7.1e-06 -1.7e-06 ] [ 3.6e-06 -3.7e-06 1.12e-05 ] [ 5.1e-06 4.6e-06 -4.8e-06 ] [ -5e-06 4.2e-06 1.62e-05 ] [ 7.8e-06 -1.2e-06 -1.76e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.24848882112e-15 4.96674752448e-15 -5.44740051072e-15 ] [ -1.217654231808e-14 -1.137545400768e-14 -2.72370025536e-15 ] [ 5.76783583488e-15 -5.928053496960001e-15 1.794437815296e-14 ] [ 8.17110076608e-15 7.370012455680001e-15 -7.69044777984e-15 ] [ -8.010883104e-15 6.72914180736e-15 2.595526125696e-14 ] [ 1.249697764224e-14 -1.92261194496e-15 -2.819830852608e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.273917 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.767586596703968e-18 } }