{ "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" [ [ 2.875077 1.739271 0.5500127 ] [ 2.247142 4.095662 1.890424 ] [ 4.370849 2.938246 1.693427 ] [ 3.902852 1.049683 3.036341 ] [ 5.923496 0.662055 4.457524 ] [ 5.031061 2.817229 4.209838 ] [ 4.680107 5.055758 2.976326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.875077e-10 1.739271e-10 5.500127000000001e-11 ] [ 2.247142e-10 4.095662e-10 1.890424e-10 ] [ 4.370849e-10 2.938246e-10 1.693427e-10 ] [ 3.902852e-10 1.049683e-10 3.036341e-10 ] [ 5.923496e-10 6.62055e-11 4.457524e-10 ] [ 5.031061e-10 2.817229e-10 4.209838000000001e-10 ] [ 4.680106999999999e-10 5.055758e-10 2.976326e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.5679473 -4.3526986 -6.1273337 ] [ -1.2983738 1.4739541 0.3443292 ] [ 3.2007357 2.0672777 -1.451714 ] [ -2.928142 -2.6477604 -0.2023022 ] [ 4.7129402 -5.0900886 1.9989533 ] [ -0.1018636 4.3004232 4.9933078 ] [ 0.9826507 4.2488926 0.4447596 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.318658369106484e-09 -6.973791934308891e-09 -9.817070801979962e-09 ] [ -2.080224147419255e-09 2.361534799152305e-09 5.516761940987674e-10 ] [ 5.128143907899923e-09 3.312143999641196e-09 -2.325902230888051e-09 ] [ -4.691400654782553e-09 -4.242179810360056e-09 -3.241238551764057e-10 ] [ 7.550962603668477e-09 -8.155220952720603e-09 3.202676243331009e-09 ] [ -1.632034784305229e-10 6.890037510585922e-09 8.000161017618283e-09 ] [ 1.574379977952754e-09 6.807476388010125e-09 7.125834329963596e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -14.226724 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.279372458337426e-18 } "relaxed-configuration-positions" { "source-value" [ [ 4.3463806 1.7437095 0.1127259 ] [ 1.3348022 3.7314399 1.7855158 ] [ 3.5930381 3.0094358 1.9983059 ] [ 3.9020728 1.766476 4.0085066 ] [ 5.211575 -0.1392809 3.3535473 ] [ 5.5038286 3.4368549 4.8956487 ] [ 5.1388867 4.8092687 2.6596424 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.3463806e-10 1.7437095e-10 1.127259e-11 ] [ 1.3348022e-10 3.7314399e-10 1.7855158e-10 ] [ 3.5930381e-10 3.0094358e-10 1.9983059e-10 ] [ 3.9020728e-10 1.766476e-10 4.0085066e-10 ] [ 5.211575e-10 -1.392809e-11 3.3535473e-10 ] [ 5.5038286e-10 3.436854900000001e-10 4.8956487e-10 ] [ 5.138886699999999e-10 4.8092687e-10 2.6596424e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.84e-05 -6.16e-05 -5.01e-05 ] [ -3.59e-05 4.91e-05 -1.12e-05 ] [ -1.54e-05 -6.57e-05 0.0001002 ] [ -3.05e-05 1.61e-05 6.6e-06 ] [ 1.88e-05 2.03e-05 -5.07e-05 ] [ -1.1e-06 1.36e-05 -5.8e-06 ] [ 2.57e-05 2.82e-05 1.09e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.152358223872e-14 -9.869407984128002e-14 -8.026904870208e-14 ] [ -5.751814068672e-14 7.866687208128001e-14 -1.794437815296e-14 ] [ -2.467351996032e-14 -1.0526300398656e-13 1.6053809740416e-13 ] [ -4.88663869344e-14 2.579504359488e-14 1.057436569728e-14 ] [ 3.012092047104e-14 3.252418540224e-14 -8.123035467456e-14 ] [ -1.76239428288e-15 2.178960204288e-14 -9.292624400640001e-15 ] [ 4.117593915456e-14 4.518138070656001e-14 1.746372516672e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.646698 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.307965683231812e-18 } }