{ "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" [ [ 1.442259 2.324158 2.548252 ] [ 2.158618 1.41899 4.605472 ] [ 2.34516 4.213318 2.000238 ] [ 2.029556 3.900131 4.500233 ] [ 3.591834 1.471441 2.657937 ] [ 4.338938 2.513725 4.512162 ] [ 5.128703 3.807673 2.402827 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.442259e-10 2.324158e-10 2.548252e-10 ] [ 2.158618e-10 1.41899e-10 4.605472e-10 ] [ 2.34516e-10 4.213318e-10 2.000238e-10 ] [ 2.029556e-10 3.900131e-10 4.500233e-10 ] [ 3.591834e-10 1.471441e-10 2.657937e-10 ] [ 4.338938e-10 2.513725e-10 4.512162e-10 ] [ 5.128703e-10 3.807673e-10 2.402827e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.2878613 -7.0670486 -4.7463208 ] [ -4.4461022 -3.7083315 7.0542836 ] [ 3.4672965 7.3470834 -2.5095036 ] [ -0.4468554 4.3588294 4.3254298 ] [ 3.2904922 -4.9457832 -8.5423857 ] [ 5.5750671 3.5603346 4.8634122 ] [ -0.1520369 0.4549159 -0.4449156 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.167644108669286e-08 -1.132266013826241e-08 -7.604444283228188e-09 ] [ -7.123441057215994e-09 -5.94140208042617e-09 1.13022083535294e-08 ] [ 5.55522143544998e-09 1.177132535152928e-08 -4.020668030858882e-09 ] [ -7.159412806567235e-10 6.983614616272239e-09 6.930102557567293e-09 ] [ 5.271949717199255e-09 -7.924018279869749e-09 -1.368641076715573e-08 ] [ 8.932242240602142e-09 5.704284905341736e-09 7.792045388350533e-09 ] [ -2.435899686857946e-10 7.288556254150805e-10 -7.128333784220904e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -11.879918 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.903372703343601e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7275474 1.8968399 2.2666646 ] [ 0.9358702 1.7776666 4.6659851 ] [ 2.3069542 4.2826486 2.4912551 ] [ 2.5821852 3.6879819 4.8652866 ] [ 3.9404596 0.8404013 2.7170794 ] [ 4.7322691 2.7716345 4.0806373 ] [ 4.8097823 4.3922633 2.1402129 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7275474e-10 1.8968399e-10 2.2666646e-10 ] [ 9.358702e-11 1.7776666e-10 4.6659851e-10 ] [ 2.3069542e-10 4.2826486e-10 2.4912551e-10 ] [ 2.5821852e-10 3.6879819e-10 4.8652866e-10 ] [ 3.9404596e-10 8.404013e-11 2.7170794e-10 ] [ 4.7322691e-10 2.7716345e-10 4.080637300000001e-10 ] [ 4.8097823e-10 4.3922633e-10 2.1402129e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8e-06 5.1e-06 -1.52e-05 ] [ 5e-07 1.8e-06 5.1e-06 ] [ 1.64e-05 -1.65e-05 1.03e-05 ] [ -3.6e-06 1.8e-06 -0.0 ] [ -9.6e-06 5.5e-06 5e-06 ] [ 2.3e-06 -1.4e-06 5e-07 ] [ -1.4e-05 3.6e-06 -5.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.2817413072e-14 8.1711008334e-15 -2.43530848368e-14 ] [ 8.010883169999999e-16 2.8839179412e-15 8.1711008334e-15 ] [ 2.62756967976e-14 -2.6435914461e-14 1.65024193302e-14 ] [ -5.767835882399999e-15 2.8839179412e-15 0.0 ] [ -1.53808956864e-14 8.811971486999999e-15 8.010883169999999e-15 ] [ 3.685006258199999e-15 -2.2430472876e-15 8.010883169999999e-16 ] [ -2.243047287599999e-14 5.767835882399999e-15 -9.1324068138e-15 ] ] } "relaxed-potential-energy" { "source-value" -20.813779 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.334735037903988e-18 } }