{ "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" [ [ 1.239329 2.983674 3.512225 ] [ 2.999663 5.449943 1.062375 ] [ 1.178907 3.936124 1.554887 ] [ 2.122325 5.087093 3.38156 ] [ 3.136296 3.082629 1.288456 ] [ 5.117946 4.70791 1.219676 ] [ 3.839933 3.58316 3.463374 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.239329e-10 2.983674e-10 3.512225e-10 ] [ 2.999663e-10 5.449943e-10 1.062375e-10 ] [ 1.178907e-10 3.936124e-10 1.554887e-10 ] [ 2.122325e-10 5.087093000000001e-10 3.38156e-10 ] [ 3.136296e-10 3.082629e-10 1.288456e-10 ] [ 5.117946e-10 4.70791e-10 1.219676e-10 ] [ 3.839933e-10 3.58316e-10 3.463374e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.3218182 -2.5129494 2.9695345 ] [ 5.866165 0.0964871 0.1401819 ] [ -5.0780535 -0.7204706 -7.0650313 ] [ 6.0218693 1.7276411 5.1855809 ] [ 4.4637935 -2.5306538 3.9640222 ] [ -5.9381834 2.2766546 -0.4688741 ] [ -4.0137727 1.663291 -4.7254141 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.117786216987939e-09 -4.026188777933388e-09 4.757718750559018e-09 ] [ 9.398632416755232e-09 1.545893758287917e-10 2.245961628393235e-10 ] [ -8.135938596871614e-09 -1.154321151293748e-09 -1.131942797408023e-08 ] [ 9.648098205973261e-09 2.767986179553195e-09 8.308216483247022e-09 ] [ 7.151785585779005e-09 -4.054554353698679e-09 6.351063693172181e-09 ] [ -9.514018613502654e-09 3.647602773756776e-09 -7.512191211186413e-10 ] [ -6.430772781145292e-09 2.664885953787053e-09 -7.570947994618674e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.7661203 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.564704962058028e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5117205 3.881622 3.4949654 ] [ 3.9239016 6.571566 -0.0620723 ] [ 0.8194905 2.6603178 1.6734932 ] [ 2.5069204 4.1621426 4.4033602 ] [ 2.996365 2.3327045 1.5514689 ] [ 4.8300286 5.4228991 1.5731353 ] [ 4.0459723 3.7992811 2.8482024 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.117205e-11 3.881622e-10 3.4949654e-10 ] [ 3.9239016e-10 6.571566e-10 -6.20723e-12 ] [ 8.194905e-11 2.6603178e-10 1.6734932e-10 ] [ 2.5069204e-10 4.1621426e-10 4.4033602e-10 ] [ 2.996365e-10 2.332704500000001e-10 1.5514689e-10 ] [ 4.8300286e-10 5.422899100000001e-10 1.5731353e-10 ] [ 4.0459723e-10 3.7992811e-10 2.8482024e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0291187 -0.37854 -0.2193808 ] [ 0.1048343 0.2681198 -0.2229282 ] [ -0.6115635 0.1999332 0.440068 ] [ 0.0066956 0.079367 -0.1394867 ] [ 0.4284694 -0.0916648 0.0147566 ] [ 0.0729331 -0.1939514 0.2704853 ] [ -0.0304876 0.1167363 -0.1435141 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.665330036808896e-11 -6.064879380376319e-10 -3.514867888124006e-10 ] [ 1.679630645179334e-10 4.295752751335719e-10 -3.571703501570266e-10 ] [ -9.798327418346208e-10 3.203282987617306e-10 7.050666611622143e-10 ] [ 1.072753378222848e-11 1.271599518630336e-10 -2.234823296525434e-10 ] [ 6.864836554082035e-10 -1.468631995103078e-10 2.364267952249728e-11 ] [ 1.168517077024685e-10 -3.107443986514292e-10 4.333652239300742e-10 ] [ -4.884651994430208e-11 1.87032170658695e-10 -2.299349357751533e-10 ] ] } "relaxed-potential-energy" { "source-value" -15.830562 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.536335633052489e-18 } }