{ "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" [ [ 1.302275 0.3737398 2.647818 ] [ 0.2826825 1.480501 1.727575 ] [ 0.6414777 2.53008 2.452953 ] [ 2.763361 0.4669357 0.177905 ] [ 2.062003 2.101671 0.3497139 ] [ 2.601995 2.989286 1.853157 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.302275e-10 3.737398e-11 2.647818e-10 ] [ 2.826825e-11 1.480501e-10 1.727575e-10 ] [ 6.414777000000001e-11 2.53008e-10 2.452953e-10 ] [ 2.763361e-10 4.669357e-11 1.77905e-11 ] [ 2.062003e-10 2.101671e-10 3.497139e-11 ] [ 2.601995e-10 2.989286e-10 1.853157e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 13.898781 -19.5878654 13.6212003 ] [ -39.2248508 -60.845576 -66.5036384 ] [ 20.1973583 79.480385 56.3187004 ] [ 7.5368937 -16.153016 -2.7293143 ] [ -11.3747293 6.4992057 -12.732305 ] [ 8.9665471 10.6068666 12.0253569 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.226830215928315e-08 -3.138322025381706e-08 2.182356884769379e-08 ] [ -6.28451394238962e-08 -9.748536014947116e-08 -1.065505755204651e-07 ] [ 3.235973553678596e-08 1.273416157083241e-07 9.023250583812644e-08 ] [ 1.207543497908181e-08 -2.587998480382814e-08 -4.372843598302066e-09 ] [ -1.822432550253517e-08 1.041287551209961e-08 -2.039940156796137e-08 ] [ 1.436599225128046e-08 1.699407382647502e-08 1.926674584069067e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 30.068563 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.817514905655694e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.1898635 -0.7820402 3.0154218 ] [ 0.4567987 1.2520474 1.9863098 ] [ 0.8304427 3.3480554 3.0503907 ] [ 3.6636102 0.4136974 -0.5598309 ] [ 2.0696938 1.8072369 0.3263565 ] [ 2.4433852 3.9032166 1.390474 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.898635e-11 -7.820401999999999e-11 3.0154218e-10 ] [ 4.567987e-11 1.2520474e-10 1.9863098e-10 ] [ 8.304427e-11 3.3480554e-10 3.0503907e-10 ] [ 3.6636102e-10 4.136974e-11 -5.598309e-11 ] [ 2.0696938e-10 1.8072369e-10 3.263565e-11 ] [ 2.4433852e-10 3.9032166e-10 1.390474e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.68e-05 -1.23e-05 1.14e-05 ] [ 1.6e-06 -1.47e-05 1.35e-05 ] [ 9e-06 -1.6e-05 7e-06 ] [ 1.3e-05 2.05e-05 1.63e-05 ] [ -1.53e-05 1.3e-05 -1.94e-05 ] [ 1.85e-05 9.5e-06 -2.88e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.293833379119999e-14 -1.97067725982e-14 1.82648136276e-14 ] [ 2.5634826144e-15 -2.35519965198e-14 2.162938455899999e-14 ] [ 1.4419589706e-14 -2.5634826144e-14 1.1215236438e-14 ] [ 2.082829624199999e-14 3.2844620997e-14 2.61154791342e-14 ] [ -2.45133025002e-14 2.082829624199999e-14 -3.10822266996e-14 ] [ 2.9640267729e-14 1.5220678023e-14 -4.614268705919999e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.969384 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.238142063617345e-18 } }