{ "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" [ [ 1.0085734 -0.4635634 -3.0705724 ] [ -5.5763329 -6.6048191 2.4949655 ] [ -0.3630008 0.9923738 -0.662696 ] [ -0.4719331 -0.0737724 -0.1352738 ] [ -0.108002 -0.0664432 -0.5825313 ] [ -0.5821179 -0.5342882 0.8070815 ] [ 6.0928132 6.7505126 1.1490264 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.615912721840767e-09 -7.427104417385588e-10 -4.919599311753746e-09 ] [ -8.934270202177863e-09 -1.05820867466333e-08 3.997375393802582e-09 ] [ -5.815913950916967e-10 1.589958101454455e-09 -1.061756037897677e-09 ] [ -7.561201794016685e-10 -1.181964145403059e-10 -2.16732519766775e-10 ] [ -1.730382793996416e-10 -1.064537416511385e-10 -9.33318029744231e-10 ] [ -9.326556899291923e-10 -8.560240628093146e-10 1.293087110380195e-09 ] [ 9.761762863941636e-09 1.081551346613582e-08 1.840943234761989e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.6232701589289285 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.00947198107823e-19 } "relaxed-configuration-positions" { "source-value" [ [ 3.0032034 2.1600289 3.0645361 ] [ 2.3674132 1.4421539 5.2133178 ] [ 3.047784 4.5505815 3.0990205 ] [ 1.3760742 3.3946152 4.4431082 ] [ 4.4770877 1.1706601 1.6355523 ] [ 3.615384 3.1664622 1.0585559 ] [ 3.6582094 3.4179552 5.1948287 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.0032034e-10 2.1600289e-10 3.0645361e-10 ] [ 2.3674132e-10 1.4421539e-10 5.2133178e-10 ] [ 3.047784e-10 4.5505815e-10 3.0990205e-10 ] [ 1.3760742e-10 3.3946152e-10 4.4431082e-10 ] [ 4.477087700000001e-10 1.1706601e-10 1.6355523e-10 ] [ 3.615384e-10 3.1664622e-10 1.0585559e-10 ] [ 3.6582094e-10 3.4179552e-10 5.1948287e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.3e-05 -3.28e-05 2.9e-06 ] [ 1.88e-05 -7.5e-06 -1.05e-05 ] [ 1.6e-06 2.27e-05 -6.53e-05 ] [ 2.99e-05 7.4e-06 6.7e-06 ] [ -3.64e-05 3.23e-05 5.2e-06 ] [ 8.8e-06 -6.9e-06 3.9e-06 ] [ -3.56e-05 -1.52e-05 5.7e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.08282960704e-14 -5.255139316223999e-14 4.646312200320001e-15 ] [ 3.012092047104e-14 -1.2016324656e-14 -1.68228545184e-14 ] [ 2.56348259328e-15 3.636940929216e-14 -1.0462213333824e-13 ] [ 4.790508096192e-14 1.185610699392e-14 1.073458335936e-14 ] [ -5.831922899712e-14 5.175030485184e-14 8.33131842816e-15 ] [ 1.409915426304e-14 -1.105501868352e-14 6.24848882112e-15 ] [ -5.703748770048e-14 -2.435308463616e-14 9.13240673856e-14 ] ] } "relaxed-potential-energy" { "source-value" -7.992433158928929 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.280528955054262e-18 } }