{ "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" [ [ 2.851893 1.689536 1.360291 ] [ 1.367517 2.93292 5.4803 ] [ 1.756353 1.339195 3.328571 ] [ 1.204701 3.536746 3.011508 ] [ 3.888723 1.68848 3.240915 ] [ 3.83892 3.544284 1.733331 ] [ 3.269318 3.65155 3.991072 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.851893e-10 1.689536e-10 1.360291e-10 ] [ 1.367517e-10 2.93292e-10 5.4803e-10 ] [ 1.756353e-10 1.339195e-10 3.328571e-10 ] [ 1.204701e-10 3.536746e-10 3.011508e-10 ] [ 3.888723e-10 1.68848e-10 3.240915e-10 ] [ 3.83892e-10 3.544284e-10 1.733331e-10 ] [ 3.269318e-10 3.65155e-10 3.991072e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.9993535 -3.8731428 -9.0641669 ] [ -0.83383 -0.1410042 0.6189545 ] [ -7.5687697 -6.600869 3.132533 ] [ -4.4384524 3.3511562 -1.7836398 ] [ 9.9631191 -6.0783918 4.4490865 ] [ 2.8302959 6.0487442 -3.789351 ] [ 3.0469907 7.2935074 6.4365836 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.805494055214653e-09 -6.20545884317985e-09 -1.452239629420921e-08 ] [ -1.335942931721664e-09 -2.259136326746074e-10 9.916744292389535e-10 ] [ -1.212650586155943e-08 -1.057575798876347e-08 5.018871136484486e-09 ] [ -7.111184667813651e-09 5.369144116288969e-09 -2.857705987488388e-09 ] [ 1.596267649226594e-08 -9.73865723402243e-09 7.128222374216899e-09 ] [ 4.534633920926095e-09 9.691156542439599e-09 -6.071209580205101e-09 ] [ 4.881817263335027e-09 1.168548703991179e-08 1.03125437617447e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -17.83208 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.857014167623527e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4052267 1.678933 1.3300968 ] [ 1.0207939 3.1345609 5.0884517 ] [ 1.9487002 1.1848157 3.8243118 ] [ 1.2880307 3.6016568 2.6448938 ] [ 4.356377 1.549518 2.961893 ] [ 3.7487589 3.7722844 1.877179 ] [ 3.4095376 3.4609422 4.419162 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4052267e-10 1.678933e-10 1.3300968e-10 ] [ 1.0207939e-10 3.1345609e-10 5.0884517e-10 ] [ 1.9487002e-10 1.1848157e-10 3.8243118e-10 ] [ 1.2880307e-10 3.6016568e-10 2.6448938e-10 ] [ 4.356377e-10 1.549518e-10 2.961893e-10 ] [ 3.7487589e-10 3.7722844e-10 1.877179e-10 ] [ 3.4095376e-10 3.4609422e-10 4.419162e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.1e-06 -5.1e-06 -2.17e-05 ] [ -1.1e-05 5.3e-06 1.55e-05 ] [ -8.4e-06 -3.38e-05 1.49e-05 ] [ -3.15e-05 2.21e-05 -2.19e-05 ] [ 1.94e-05 -1.25e-05 -1.4e-06 ] [ 1.01e-05 9.3e-06 -1.37e-05 ] [ 2.26e-05 1.48e-05 2.83e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.76239428288e-15 -8.17110076608e-15 -3.476723267136e-14 ] [ -1.76239428288e-14 8.491536090240001e-15 2.48337376224e-14 ] [ -1.345828361472e-14 -5.415356978304e-14 2.387243164992e-14 ] [ -5.04685635552e-14 3.540810331968e-14 -3.508766799552e-14 ] [ 3.108222644352e-14 -2.002720776e-14 -2.24304726912e-15 ] [ 1.618198387008e-14 1.490024257344e-14 -2.194981970496e-14 ] [ 3.620919163008e-14 2.371221398784e-14 4.534159836864e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.005399 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.84608890507757e-18 } }