{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.232696 1.429874 2.018017 ] [ 2.664166 0.3933008 4.008788 ] [ 2.480457 2.487888 4.841749 ] [ 1.659099 3.474448 2.765735 ] [ 4.127261 1.03872 2.31822 ] [ 4.538799 1.714568 4.545045 ] [ 3.952007 3.51716 3.378238 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.232696e-10 1.429874e-10 2.018017e-10 ] [ 2.664166e-10 3.933008e-11 4.008788e-10 ] [ 2.480457e-10 2.487888e-10 4.841749e-10 ] [ 1.659099e-10 3.474448e-10 2.765735e-10 ] [ 4.127261e-10 1.03872e-10 2.31822e-10 ] [ 4.538799e-10 1.714568e-10 4.545045e-10 ] [ 3.952007e-10 3.51716e-10 3.378238e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.9775424 -0.8813897 0.4398111 ] [ -4.9821013 -4.9915729 -1.0147395 ] [ -6.7482204 1.728851 5.7268387 ] [ -1.5580722 0.936176 -1.0381013 ] [ 0.804112 -1.6836452 -4.6917099 ] [ 8.5714666 -1.2746065 4.2850368 ] [ 2.9352728 6.1661874 -3.707136 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.566195579120722e-09 -1.412141971153926e-09 7.046550619883309e-10 ] [ -7.982206225317287e-09 -7.997381401398858e-09 -1.625791903102281e-09 ] [ -1.081184095688563e-08 2.769924653046701e-09 9.175407076232666e-09 ] [ -2.496306852358422e-09 1.499919300154061e-09 -1.663221632882087e-09 ] [ 1.28832944690473e-09 -2.69749697716214e-09 -7.516947913355907e-09 ] [ 1.373300339248807e-08 -2.042144735019715e-09 6.865385780227647e-09 ] [ 4.702825455830154e-09 9.879321291751539e-09 -5.939486629326029e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.0177949 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.284592353914947e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8133416 1.2481247 2.0772545 ] [ 1.7636131 0.2072479 4.1159277 ] [ 2.2685862 2.1661565 5.1882009 ] [ 1.9691947 3.3126849 3.1694382 ] [ 4.0216888 1.4215603 1.4982804 ] [ 4.5309615 2.4485411 4.9784327 ] [ 4.2870991 3.2516433 2.8482576 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8133416e-10 1.2481247e-10 2.0772545e-10 ] [ 1.7636131e-10 2.072479e-11 4.115927700000001e-10 ] [ 2.2685862e-10 2.1661565e-10 5.188200900000001e-10 ] [ 1.9691947e-10 3.3126849e-10 3.1694382e-10 ] [ 4.0216888e-10 1.4215603e-10 1.4982804e-10 ] [ 4.5309615e-10 2.4485411e-10 4.9784327e-10 ] [ 4.2870991e-10 3.2516433e-10 2.8482576e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9.5e-06 -5.2e-06 -1.03e-05 ] [ 3.6e-06 -6e-07 5.4e-06 ] [ -9.5e-06 -5.7e-06 6.6e-06 ] [ 3.1e-06 3e-06 1.5e-06 ] [ -1.6e-06 -3.1e-06 -2.5e-06 ] [ 1.1e-06 3.6e-06 -1.5e-06 ] [ 1.27e-05 8e-06 8e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.52206778976e-14 -8.33131842816e-15 -1.650241919424e-14 ] [ 5.76783583488e-15 -9.6130597248e-16 8.65175375232e-15 ] [ -1.52206778976e-14 -9.13240673856e-15 1.057436569728e-14 ] [ 4.96674752448e-15 4.8065298624e-15 2.4032649312e-15 ] [ -2.56348259328e-15 -4.96674752448e-15 -4.005441552e-15 ] [ 1.76239428288e-15 5.76783583488e-15 -2.4032649312e-15 ] [ 2.034764308416e-14 1.28174129664e-14 1.28174129664e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.403283 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.307660328536609e-18 } }