{ "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" [ [ 2.272226 1.517825 2.823083 ] [ 2.079314 3.025232 4.309487 ] [ 1.624731 3.89644 2.167347 ] [ 4.204366 1.580563 1.938725 ] [ 4.130904 2.338344 4.256427 ] [ 3.588528 3.628489 1.149971 ] [ 3.881136 4.134812 3.114475 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.272226e-10 1.517825e-10 2.823083e-10 ] [ 2.079314e-10 3.025232e-10 4.309487e-10 ] [ 1.624731e-10 3.89644e-10 2.167347e-10 ] [ 4.204366000000001e-10 1.580563e-10 1.938725e-10 ] [ 4.130904e-10 2.338344e-10 4.256427000000001e-10 ] [ 3.588528e-10 3.628489e-10 1.149971e-10 ] [ 3.881136e-10 4.134812e-10 3.114475e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.318581 -4.3517161 -2.5538653 ] [ -8.1029215 6.6905124 9.2027588 ] [ -7.4479982 4.0034948 0.2318359 ] [ 12.3060483 -6.2225007 -5.2298805 ] [ 6.6596491 -8.4866872 9.719557 ] [ -0.2334317 1.2828592 -16.3166471 ] [ 2.137235 7.0840377 4.9462412 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.521306204236353e-09 -6.972217853221607e-09 -4.0917433100434e-09 ] [ -1.298231149443623e-08 1.071938263676726e-08 1.474444511769788e-08 ] [ -1.193300868611406e-08 6.414305822900503e-09 3.714420619023606e-10 ] [ 1.971646304313542e-08 -9.969545226588644e-09 -8.379192335712236e-09 ] [ 1.066993417865913e-08 -1.359717193190688e-08 1.557244711823114e-08 ] [ -3.739988153748978e-10 2.055367034951933e-09 -2.614215072884386e-08 ] [ 3.42422797836699e-09 1.13498796773151e-08 7.92475207676812e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.730197 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.36003774476169e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1444428 1.4570231 2.5071136 ] [ 2.0256114 3.2416553 4.5016853 ] [ 1.5419452 4.0598574 2.3089541 ] [ 4.7528551 1.9150252 2.1027318 ] [ 4.0100296 1.9160259 4.3742207 ] [ 3.2275592 3.2400772 0.8263472 ] [ 4.0787617 4.2920408 3.1384623 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1444428e-10 1.4570231e-10 2.5071136e-10 ] [ 2.0256114e-10 3.2416553e-10 4.5016853e-10 ] [ 1.5419452e-10 4.059857400000001e-10 2.3089541e-10 ] [ 4.7528551e-10 1.9150252e-10 2.1027318e-10 ] [ 4.0100296e-10 1.9160259e-10 4.3742207e-10 ] [ 3.2275592e-10 3.2400772e-10 8.263472e-11 ] [ 4.0787617e-10 4.2920408e-10 3.1384623e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.41e-05 -0.0001014 -2.32e-05 ] [ -1.08e-05 -2.08e-05 -1.48e-05 ] [ 3.69e-05 4.72e-05 1.31e-05 ] [ 3.54e-05 2.28e-05 8.4e-06 ] [ 5.9e-06 1.86e-05 8.4e-06 ] [ -3.75e-05 -2.47e-05 -1.37e-05 ] [ 4.43e-05 5.83e-05 2.19e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.187212885794e-13 -1.624607106876e-13 -3.71704979088e-14 ] [ -1.73035076472e-14 -3.332527398719999e-14 -2.37122141832e-14 ] [ 5.91203177946e-14 7.562273712480001e-14 2.09885139054e-14 ] [ 5.671705284359999e-14 3.65296272552e-14 1.34582837256e-14 ] [ 9.452842140600001e-15 2.98004853924e-14 1.34582837256e-14 ] [ -6.008162377499999e-14 -3.95737628598e-14 -2.19498198858e-14 ] [ 7.09764248862e-14 9.34068977622e-14 3.50876682846e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.729818 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.481500666067262e-18 } }