{ "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" [ [ 2.836172 2.264881 3.605889 ] [ 1.711544 3.356754 1.507539 ] [ 2.817956 4.908146 3.003841 ] [ 0.8092812 3.284881 3.852119 ] [ 4.796821 1.314646 2.655969 ] [ 4.297416 3.615744 1.848977 ] [ 4.570903 3.768738 4.135906 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.836172e-10 2.264881e-10 3.605889e-10 ] [ 1.711544e-10 3.356754e-10 1.507539e-10 ] [ 2.817956e-10 4.908146e-10 3.003841e-10 ] [ 8.092812000000001e-11 3.284881e-10 3.852119e-10 ] [ 4.796821e-10 1.314646e-10 2.655969e-10 ] [ 4.297416000000001e-10 3.615744e-10 1.848977e-10 ] [ 4.570903000000001e-10 3.768738e-10 4.135906000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4507709 -2.4375303 0.1270266 ] [ 0.0166368 -0.5381078 -0.0884508 ] [ -3.6571134 1.930539 2.2407476 ] [ -0.4042117 2.3510853 -0.8073236 ] [ 0.4300971 -0.1895347 -0.6287672 ] [ 1.4653395 -2.076677 -3.6018978 ] [ 1.6984809 0.9602255 2.7586652 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.222146032671505e-10 -3.90535409132701e-09 2.035190504164644e-10 ] [ 2.66550922245312e-11 -8.621437437331451e-10 -1.417138050186072e-10 ] [ -5.859341637368296e-09 3.093064476825726e-09 3.590073447411578e-09 ] [ -6.476185409294178e-10 3.766853932200879e-09 -1.293475007996762e-09 ] [ 6.890915239711614e-10 -3.036680676721998e-10 -1.007396116065605e-09 ] [ 2.347732707777243e-09 -3.327203365765218e-09 -5.770876493216005e-09 ] [ 2.72126641127529e-09 1.538450859470967e-09 4.419868924468936e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.61666 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.982717765512244e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7924827 1.8327719 3.9106268 ] [ 2.0859071 3.0171909 1.6885408 ] [ 2.6845725 5.123831 2.9497825 ] [ 1.0518948 3.5528558 3.8112054 ] [ 4.520169 1.4728677 2.3227353 ] [ 4.4596319 3.7598253 1.741597 ] [ 4.2454352 3.7544473 4.1857522 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7924827e-10 1.8327719e-10 3.9106268e-10 ] [ 2.0859071e-10 3.0171909e-10 1.6885408e-10 ] [ 2.6845725e-10 5.123831e-10 2.9497825e-10 ] [ 1.0518948e-10 3.5528558e-10 3.8112054e-10 ] [ 4.520169000000001e-10 1.4728677e-10 2.3227353e-10 ] [ 4.4596319e-10 3.7598253e-10 1.741597e-10 ] [ 4.2454352e-10 3.7544473e-10 4.1857522e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.75e-05 2.77e-05 7.8e-06 ] [ -2.26e-05 7.3e-05 3.6e-05 ] [ -6.6e-05 -3.47e-05 -1.37e-05 ] [ 4.02e-05 1.21e-05 -2.28e-05 ] [ 6.71e-05 -6.42e-05 -1.72e-05 ] [ -1.2e-06 -6.4e-06 2.42e-05 ] [ -1e-07 -7.5e-06 -1.43e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.8038091095e-14 4.438029276179999e-14 1.24969777452e-14 ] [ -3.62091919284e-14 1.16958894282e-13 5.7678358824e-14 ] [ -1.05743657844e-13 -5.55955291998e-14 -2.19498198858e-14 ] [ 6.44075006868e-14 1.93863372714e-14 -3.65296272552e-14 ] [ 1.075060521414e-13 -1.028597399028e-13 -2.75574381048e-14 ] [ -1.9226119608e-15 -1.02539304576e-14 3.877267454279999e-14 ] [ -1.602176634e-16 -1.2016324755e-14 -2.29111258662e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.073967 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.376421751308708e-18 } }