{ "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" [ [ 1.175063 2.090387 1.108777 ] [ 2.290473 2.943113 3.7458 ] [ 1.562387 4.346014 1.227002 ] [ 3.205072 1.346551 2.036178 ] [ 4.414518 1.768723 4.119804 ] [ 3.44377 3.554925 2.238453 ] [ 4.008705 3.851776 5.027783 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.175063e-10 2.090387e-10 1.108777e-10 ] [ 2.290473e-10 2.943113e-10 3.7458e-10 ] [ 1.562387e-10 4.346014000000001e-10 1.227002e-10 ] [ 3.205072e-10 1.346551e-10 2.036178e-10 ] [ 4.414518e-10 1.768723e-10 4.119804e-10 ] [ 3.44377e-10 3.554925e-10 2.238453e-10 ] [ 4.008705e-10 3.851776e-10 5.027783000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.4498809 -1.5930055 -1.6188318 ] [ -9.3443484 0.0747237 8.2120678 ] [ -1.75782 2.3928785 -1.4271357 ] [ 1.3428767 -7.5506225 -3.4264617 ] [ 3.9807254 -4.1578691 2.3548372 ] [ 6.8313542 8.2476287 -6.8988264 ] [ 1.3970929 2.5862662 2.8043506 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.925141901724463e-09 -2.552276168905815e-09 -2.593654462967581e-09 ] [ -1.497129654308989e-08 1.19720565159673e-10 1.315718303758449e-08 ] [ -2.816338107574656e-09 3.833813989114973e-09 -2.286523453249043e-09 ] [ 2.151525653357055e-09 -1.209743084198645e-08 -5.489796827806624e-09 ] [ 6.377825169704728e-09 -6.661640664366738e-09 3.772865107630133e-09 ] [ 1.094503598764389e-08 1.32141578801791e-08 -1.105313836903783e-08 ] [ 2.238389581465673e-09 4.143655240805257e-09 4.493064967846452e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.546069 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.170319505554364e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.538933 1.6405984 1.9994661 ] [ 1.4947536 3.284587 4.1092685 ] [ 1.678112 4.1256454 1.7618595 ] [ 4.0030711 1.6703591 1.5769158 ] [ 3.3312286 1.3450704 3.9631606 ] [ 4.1067509 4.0836997 1.8453931 ] [ 3.9471388 3.751529 4.2477333 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.538933e-10 1.6405984e-10 1.9994661e-10 ] [ 1.4947536e-10 3.284587e-10 4.1092685e-10 ] [ 1.678112e-10 4.1256454e-10 1.7618595e-10 ] [ 4.0030711e-10 1.6703591e-10 1.5769158e-10 ] [ 3.331228600000001e-10 1.3450704e-10 3.9631606e-10 ] [ 4.1067509e-10 4.0836997e-10 1.8453931e-10 ] [ 3.9471388e-10 3.751529e-10 4.2477333e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.16e-05 -1.39e-05 2.64e-05 ] [ 5.01e-05 -1.48e-05 -2.16e-05 ] [ 1e-05 1.35e-05 6.4e-06 ] [ -7.33e-05 2.14e-05 5.3e-06 ] [ -8.3e-06 1.44e-05 -1.09e-05 ] [ 1.71e-05 -1.81e-05 2.92e-05 ] [ -5.72e-05 -2.6e-06 -3.47e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.869407984128002e-14 -2.227025502912e-14 4.229746278912e-14 ] [ 8.026904870208e-14 -2.371221398784e-14 -3.460701500928e-14 ] [ 1.6021766208e-14 2.16293843808e-14 1.025393037312e-14 ] [ -1.1743954630464e-13 3.428657968511999e-14 8.491536090240001e-15 ] [ -1.329806595264e-14 2.307134333952e-14 -1.746372516672e-14 ] [ 2.739722021568e-14 -2.899939683648e-14 4.678355732736e-14 ] [ -9.164450270976e-14 -4.16565921408e-15 -5.559552874176001e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.651699 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.148549269679874e-18 } }