{ "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" [ [ 1.497272 0.041495 0.0459008 ] [ 0.5144624 2.623314 0.1336692 ] [ 0.1881884 1.665255 2.217108 ] [ 2.303156 0.3070008 2.474488 ] [ 2.009269 2.269424 0.9602388 ] [ 2.927445 2.103094 2.701001 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.497272e-10 4.1495e-12 4.59008e-12 ] [ 5.144624e-11 2.623314e-10 1.336692e-11 ] [ 1.881884e-11 1.665255e-10 2.217108e-10 ] [ 2.303156e-10 3.070008e-11 2.474488e-10 ] [ 2.009269e-10 2.269424e-10 9.602388e-11 ] [ 2.927445e-10 2.103094e-10 2.701001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.4894128 -7.1430305 -4.9495311 ] [ -17.8683683 8.0860485 -12.403012 ] [ -15.8039488 -0.9225953 9.5130749 ] [ 0.21582 -18.7615694 5.306843 ] [ 19.229368 8.2553051 -9.1584688 ] [ 12.7377163 10.4858415 11.6910939 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.386302366880266e-09 -1.144439646876134e-08 -7.930023012342507e-09 ] [ -2.862828194210384e-08 1.295527786135491e-08 -1.987181585390185e-08 ] [ -2.532071728368022e-08 -1.478160620119962e-09 1.52416261966993e-08 ] [ 3.45781758301056e-10 -3.005934786219668e-08 8.502499784856134e-09 ] [ 3.080884384235966e-08 1.322645682879101e-08 -1.467348459368623e-08 ] [ 2.040807125824308e-08 1.68001701007144e-08 1.873119731815749e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 3.706022 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.937701804570458e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.818346 0.2153958 0.0167613 ] [ 0.190668 2.2214438 0.2998104 ] [ 0.1587435 1.8609611 2.6707296 ] [ 1.7864845 -0.1450626 2.3876855 ] [ 2.7587456 2.6086398 0.3932465 ] [ 2.7268053 2.2482049 2.7641725 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.818346e-10 2.153958e-11 1.67613e-12 ] [ 1.90668e-11 2.2214438e-10 2.998104e-11 ] [ 1.587435e-11 1.8609611e-10 2.6707296e-10 ] [ 1.7864845e-10 -1.450626e-11 2.3876855e-10 ] [ 2.7587456e-10 2.6086398e-10 3.932465e-11 ] [ 2.7268053e-10 2.2482049e-10 2.7641725e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.17e-05 2.67e-05 1.1e-06 ] [ 7.8e-06 -3.31e-05 -3.7e-06 ] [ 4.48e-05 -2.07e-05 2.3e-06 ] [ -5.14e-05 6.51e-05 1.3e-06 ] [ -2.73e-05 -3.1e-06 -2.8e-06 ] [ 4.4e-06 -3.49e-05 1.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.476723267136e-14 4.277811577536e-14 1.76239428288e-15 ] [ 1.249697764224e-14 -5.303204614848e-14 -5.928053496960001e-15 ] [ 7.177751261183999e-14 -3.316505605055999e-14 3.68500622784e-15 ] [ -8.235187830912e-14 1.0430169801408e-13 2.08282960704e-15 ] [ -4.373942174784e-14 -4.96674752448e-15 -4.48609453824e-15 ] [ 7.04957713152e-15 -5.591596406592e-14 2.72370025536e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.148122 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.426996691742614e-18 } }