{ "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" [ [ 0.6305471 0.004372 1.304235 ] [ 0.7154426 1.383697 2.938133 ] [ 2.486494 1.164331 0.5043625 ] [ 2.840403 0.4835428 2.252778 ] [ 2.544628 2.936148 1.00011 ] [ 2.473494 2.502288 2.980444 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.305471000000001e-11 4.372e-13 1.304235e-10 ] [ 7.154426000000001e-11 1.383697e-10 2.938133e-10 ] [ 2.486494e-10 1.164331e-10 5.043625000000001e-11 ] [ 2.840403e-10 4.835428e-11 2.252778e-10 ] [ 2.544628e-10 2.936148e-10 1.00011e-10 ] [ 2.473494e-10 2.502288e-10 2.980444e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.6149468 -20.1524729 -33.3792519 ] [ -40.309198 1.8643039 32.1452209 ] [ -33.1291477 -167.7049137 -180.1905174 ] [ 32.7313171 -53.1474528 119.7571726 ] [ 6.4283601 217.6432216 22.7494425 ] [ 34.8936152 21.4973139 38.9179334 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.852533941130711e-10 -3.228782119769821e-08 -5.34794574545801e-08 ] [ -6.458245517087953e-08 2.986944147255072e-09 5.150232182074844e-08 ] [ -5.307874634927484e-08 -2.686928941371265e-07 -2.886970366466504e-07 ] [ 5.244135145766463e-08 -8.515160703277788e-08 1.91872143693625e-07 ] [ 1.02993683471579e-08 3.487028841960041e-07 3.644862521002654e-08 ] [ 5.590573494922723e-08 3.444249402434341e-08 6.235340353704817e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 58.669341 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.399864728237819e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5106429 -0.085001 1.1496575 ] [ 0.4610384 1.1889114 3.4143626 ] [ 2.5909468 0.9698842 -0.0097783 ] [ 2.875607 0.2425852 2.5083825 ] [ 2.7318193 3.391663 0.7337493 ] [ 2.5209544 2.766336 3.1836889 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.106429e-11 -8.5001e-12 1.1496575e-10 ] [ 4.610384e-11 1.1889114e-10 3.4143626e-10 ] [ 2.5909468e-10 9.698842e-11 -9.7783e-13 ] [ 2.875607e-10 2.425852e-11 2.5083825e-10 ] [ 2.7318193e-10 3.391663e-10 7.337493e-11 ] [ 2.5209544e-10 2.766336e-10 3.1836889e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3e-06 -2.94e-05 -2e-05 ] [ -3.06e-05 4.3e-06 1.93e-05 ] [ -1.97e-05 -3.82e-05 -2.5e-05 ] [ 2.06e-05 -4.6e-06 -9.2e-06 ] [ 2.09e-05 3.54e-05 6.8e-06 ] [ 1.18e-05 3.25e-05 2.82e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.806529901999999e-15 -4.710399303959999e-14 -3.204353268e-14 ] [ -4.90266050004e-14 6.8893595262e-15 3.09220090362e-14 ] [ -3.15628796898e-14 -6.12031474188e-14 -4.005441585e-14 ] [ 3.300483866039999e-14 -7.370012516399999e-15 -1.47400250328e-14 ] [ 3.34854916506e-14 5.671705284359999e-14 1.08948011112e-14 ] [ 1.89056842812e-14 5.207074060499999e-14 4.51813810788e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.426274 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.272649892248171e-18 } }