{ "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" [ [ -0.1131511 -0.2675768 0.025009 ] [ -3.7014425 -1.7845858 4.0976703 ] [ -0.1628393 -0.0680154 0.3430438 ] [ -0.0338626 -0.8396603 0.0944366 ] [ -0.2486178 -0.3174742 -0.2424931 ] [ 4.3071599 3.0632937 -3.9749769 ] [ -0.0472467 0.2140188 -0.3426897 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.812880485313974e-10 -4.287052967604912e-10 4.0068835439706e-11 ] [ -5.930364685594544e-09 -2.859221670128197e-09 6.565191608495769e-09 ] [ -2.608973215569161e-10 -1.089726846321636e-10 5.496167607985692e-10 ] [ -5.42538664864884e-11 -1.34528411315743e-09 1.513041139144044e-10 ] [ -3.983296299564852e-10 -5.086497451378427e-10 -3.885167787262253e-10 ] [ 6.900830950681776e-09 4.907937589219406e-09 -6.368615109869754e-09 ] [ -7.569755877360779e-11 3.428959205967192e-10 -5.490494300524697e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -18.399607 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.947942041018284e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4901619 1.8578298 1.791042 ] [ 1.5884143 2.9060586 3.9652663 ] [ 1.7408348 4.2110867 1.9381259 ] [ 3.8389829 1.5970483 1.7059063 ] [ 3.5489564 1.4972936 4.0507204 ] [ 4.092992 3.981626 1.8549396 ] [ 3.7996457 3.850546 4.1977964 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4901619e-10 1.8578298e-10 1.791042e-10 ] [ 1.5884143e-10 2.9060586e-10 3.9652663e-10 ] [ 1.7408348e-10 4.2110867e-10 1.9381259e-10 ] [ 3.8389829e-10 1.5970483e-10 1.7059063e-10 ] [ 3.5489564e-10 1.4972936e-10 4.050720400000001e-10 ] [ 4.092992e-10 3.981626e-10 1.8549396e-10 ] [ 3.7996457e-10 3.850546e-10 4.1977964e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4e-06 7.1e-06 3.4e-05 ] [ 3.6e-06 -1.84e-05 -8.1e-06 ] [ 1.12e-05 5e-07 -1.1e-06 ] [ -9.9e-06 1.48e-05 5.2e-06 ] [ -4.4e-06 -1.8e-05 -1.08e-05 ] [ 2.13e-05 2e-07 -1.58e-05 ] [ -2.57e-05 1.36e-05 -3.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.408706535999999e-15 1.13754541014e-14 5.447400555599999e-14 ] [ 5.767835882399999e-15 -2.94800500656e-14 -1.29776307354e-14 ] [ 1.79443783008e-14 8.010883169999999e-16 -1.7623942974e-15 ] [ -1.58615486766e-14 2.37122141832e-14 8.331318496799998e-15 ] [ -7.0495771896e-15 -2.8839179412e-14 -1.73035076472e-14 ] [ 3.41263623042e-14 3.204353268e-16 -2.53143908172e-14 ] [ -4.11759394938e-14 2.17896022224e-14 -5.607618218999999e-15 ] ] } "relaxed-potential-energy" { "source-value" -21.535655 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.450392323888527e-18 } }