{ "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" [ [ 2.750115 2.05781 3.008489 ] [ 2.459373 1.512643 5.182306 ] [ 3.045421 4.403069 3.012822 ] [ 1.351279 3.64529 4.777489 ] [ 4.685264 1.369475 1.888704 ] [ 3.677702 3.202643 0.9471066 ] [ 3.576002 3.111527 4.892003 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.750115e-10 2.05781e-10 3.008489e-10 ] [ 2.459373e-10 1.512643e-10 5.182306e-10 ] [ 3.045421e-10 4.403069e-10 3.012822e-10 ] [ 1.351279e-10 3.64529e-10 4.777489e-10 ] [ 4.685264e-10 1.369475e-10 1.888704e-10 ] [ 3.677702e-10 3.202643e-10 9.471066000000001e-11 ] [ 3.576002e-10 3.111527e-10 4.892003e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1546295 -0.5715521 -1.6473329 ] [ -3.9863206 -5.4909353 1.7335981 ] [ -0.2709383 0.0310727 -0.3653103 ] [ -0.1626496 0.2448952 -0.2412082 ] [ 0.1395708 -0.2301134 0.0622684 ] [ -0.2667374 0.4484104 0.6942678 ] [ 4.7017045 5.5682225 -0.2362828 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.47743771827103e-10 -9.157274197336313e-10 -2.639318280799458e-09 ] [ -6.38678972095286e-09 -8.797448236465779e-09 2.777530368566795e-09 ] [ -4.340910135156822e-10 4.97839538952918e-11 -5.852916268195301e-10 ] [ -2.605933886494464e-10 3.923653672187568e-10 -3.864581419691987e-10 ] [ 2.236170745486872e-10 -3.686823126502955e-10 9.976497551656559e-11 ] [ -4.273604296939116e-10 7.184326653225935e-10 1.112339646898585e-09 ] [ 7.532961089872652e-09 8.921275982413064e-09 -3.785667811760951e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -18.103979 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.900577213622668e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9761017 1.6798948 2.4878933 ] [ 3.2596976 1.5212911 4.5482456 ] [ 3.1500857 4.741431 3.2126765 ] [ 1.5823821 3.253212 4.2243757 ] [ 4.3348201 1.1974654 2.47607 ] [ 3.5392367 3.1863175 1.4962563 ] [ 3.702832 3.7228452 5.2634023 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9761017e-10 1.6798948e-10 2.4878933e-10 ] [ 3.2596976e-10 1.5212911e-10 4.548245600000001e-10 ] [ 3.1500857e-10 4.741431e-10 3.2126765e-10 ] [ 1.5823821e-10 3.253212e-10 4.224375700000001e-10 ] [ 4.3348201e-10 1.1974654e-10 2.47607e-10 ] [ 3.5392367e-10 3.1863175e-10 1.4962563e-10 ] [ 3.702832e-10 3.7228452e-10 5.263402300000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9e-06 3.92e-05 7.5e-06 ] [ 1.09e-05 3.4e-05 -4.38e-05 ] [ -1.03e-05 -3.03e-05 -6.6e-06 ] [ -1.68e-05 -4.2e-06 1.39e-05 ] [ 6.1e-06 -1.75e-05 -1.34e-05 ] [ 6.4e-06 -2.52e-05 4.57e-05 ] [ -5.3e-06 4e-06 -3.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.4419589706e-14 6.280532405279998e-14 1.2016324755e-14 ] [ 1.74637253106e-14 5.447400555599999e-14 -7.01753365692e-14 ] [ -1.65024193302e-14 -4.854595201019999e-14 -1.05743657844e-14 ] [ -2.691656745119999e-14 -6.729141862799999e-15 2.22702552126e-14 ] [ 9.773277467399999e-15 -2.8038091095e-14 -2.14691668956e-14 ] [ 1.02539304576e-14 -4.037485117679999e-14 7.32194721738e-14 ] [ -8.4915361602e-15 6.408706535999999e-15 -5.2871828922e-15 ] ] } "relaxed-potential-energy" { "source-value" -21.037892 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.370641899101552e-18 } }