{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.9192407 0.3679632 0.2084149 ] [ 0.7009294 0.9640354 2.373703 ] [ 0.5234459 2.737555 0.0024849 ] [ 2.754814 0.6958427 0.7664459 ] [ 2.641472 1.152124 2.712512 ] [ 2.849889 2.552424 1.475764 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.192407e-11 3.679632e-11 2.084149e-11 ] [ 7.009294e-11 9.640354e-11 2.373703e-10 ] [ 5.234459e-11 2.737555e-10 2.4849e-13 ] [ 2.754814e-10 6.958427e-11 7.664459e-11 ] [ 2.641472e-10 1.152124e-10 2.712512e-10 ] [ 2.849889e-10 2.552424e-10 1.475764e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -28.3050581 -5.988299 -12.8693891 ] [ -29.2533464 -2.8484039 4.2846275 ] [ 0.6198623 1.1245531 0.1978304 ] [ 33.3626642 -38.6299715 -38.9645127 ] [ 15.2287993 -30.7431798 72.0776041 ] [ 8.3470787 77.0853012 -24.7261602 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.534970233820567e-08 -9.59431265616002e-09 -2.061903433999835e-08 ] [ -4.686902768224385e-08 -4.563646135175541e-09 6.864730009336753e-09 ] [ 9.93128885175316e-10 1.801732685668164e-09 3.169592417635123e-10 ] [ 5.345288058884113e-08 -6.189203719947031e-08 -6.242803128880469e-08 ] [ 2.43992262013154e-08 -4.925600392461082e-08 1.154810521722982e-07 ] [ 1.337349434511766e-08 1.235042673899662e-07 -3.961567579459545e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 18.996849 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.043630733666786e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.6381992 0.4856166 0.2251402 ] [ 0.2788969 0.4135437 2.7008471 ] [ 0.7370594 2.9678815 -0.0781957 ] [ 3.1441901 0.4015143 0.5609168 ] [ 2.6387818 1.225678 3.0172655 ] [ 2.9526635 2.9757102 1.1133509 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.381992e-11 4.856166e-11 2.251402e-11 ] [ 2.788969e-11 4.135437e-11 2.7008471e-10 ] [ 7.370594e-11 2.9678815e-10 -7.81957e-12 ] [ 3.1441901e-10 4.015143e-11 5.609168e-11 ] [ 2.6387818e-10 1.225678e-10 3.0172655e-10 ] [ 2.9526635e-10 2.9757102e-10 1.1133509e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.65e-05 3e-05 -2.57e-05 ] [ 2.28e-05 -3.25e-05 1.9e-06 ] [ 1.85e-05 -6.7e-06 -1.87e-05 ] [ 1.7e-06 -1.51e-05 8.7e-06 ] [ 1.64e-05 1.73e-05 3.76e-05 ] [ -1.29e-05 7.1e-06 -3.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.45012128672e-14 4.8065298624e-14 -4.117593915456e-14 ] [ 3.652962695424e-14 -5.207074017599999e-14 3.04413557952e-15 ] [ 2.96402674848e-14 -1.073458335936e-14 -2.996070280896e-14 ] [ 2.72370025536e-15 -2.419286697408e-14 1.393893660096e-14 ] [ 2.627569658112e-14 2.771765553984e-14 6.024184094208e-14 ] [ -2.066807840832e-14 1.137545400768e-14 -6.08827115904e-15 ] ] } "relaxed-potential-energy" { "source-value" -19.625291 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.144318241659665e-18 } }