{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.0379323e-10 -4.558792e-11 1.6631485e-10 ] [ -6.982779999999999e-12 1.491924e-10 2.5350207e-10 ] [ 1.0043731e-10 2.9121308e-10 7.449749e-11 ] [ 2.1242741e-10 9.684776e-11 -1.212561e-11 ] [ 3.2779766e-10 6.270918e-11 2.1020113e-10 ] [ 2.171399e-10 2.5780578e-10 2.9648552e-10 ] ] "source-value" [ [ 1.0379323 -0.4558792 1.6631485 ] [ -0.0698278 1.491924 2.5350207 ] [ 1.0043731 2.9121308 0.7449749 ] [ 2.1242741 0.9684776 -0.1212561 ] [ 3.2779766 0.6270918 2.1020113 ] [ 2.171399 2.5780578 2.9648552 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.1519649903552e-11 2.347973816016192e-11 -7.8410523821952e-13 ] [ 2.64054728874048e-12 -3.61435023886272e-12 -3.79924142090304e-12 ] [ 2.631783382624704e-11 -2.136150044980224e-11 1.863443562353856e-11 ] [ -9.77840435206656e-12 -1.12568929377408e-12 1.885617686785728e-11 ] [ -1.290024549769536e-11 4.890644134992e-12 -1.808520947792832e-11 ] [ -1.779922095111552e-11 -2.26900253037696e-12 -1.482205635434496e-11 ] ] "source-value" [ [ 0.00719 0.0146549 -0.0004894 ] [ 0.0016481 -0.0022559 -0.0023713 ] [ 0.0164263 -0.0133328 0.0116307 ] [ -0.0061032 -0.0007026 0.0117691 ] [ -0.0080517 0.0030525 -0.0112879 ] [ -0.0111094 -0.0014162 -0.0092512 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.532547927303256e-18 "source-value" -15.806921 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -4.17569669039165e-09 -1.711047726536602e-08 -6.103397308516973e-09 ] [ -8.880607539311437e-09 5.096906750977172e-09 1.021752459441855e-08 ] [ -2.800819585043249e-09 6.224245806017689e-09 -3.391703284100262e-09 ] [ 5.67246162521468e-09 2.872301656286214e-09 -8.734920497658458e-09 ] [ 7.003965406173094e-09 -3.31841043284047e-09 5.160236947573505e-09 ] [ 3.180696943576226e-09 6.235433484925411e-09 2.852259388065978e-09 ] ] "source-value" [ [ -2.6062649 -10.67952 -3.809441 ] [ -5.5428393 3.181239 6.3772773 ] [ -1.7481341 3.8848687 -2.1169347 ] [ 3.5404721 1.7927497 -5.4519086 ] [ 4.3715314 -2.0711889 3.2207666 ] [ 1.9852349 3.8918515 1.7802403 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.818428647798197e-18 "source-value" -11.349739 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.1028e-10 2.583089e-11 1.436622e-10 ] [ 5.420747000000001e-12 1.282802e-10 2.764068e-10 ] [ 3.917807e-11 2.567162e-10 7.355983000000001e-11 ] [ 2.495357e-10 1.268739e-10 8.693225e-12 ] [ 2.96001e-10 2.024969e-11 2.578704e-10 ] [ 2.541972e-10 2.542294e-10 2.28683e-10 ] ] "source-value" [ [ 1.1028 0.2583089 1.436622 ] [ 0.05420747 1.282802 2.764068 ] [ 0.3917807 2.567162 0.7355983 ] [ 2.495357 1.268739 0.08693225 ] [ 2.96001 0.2024969 2.578704 ] [ 2.541972 2.542294 2.28683 ] ] } "instance-id" 1 }