{ "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" [ [ 2.290406 1.365127 2.478138 ] [ 1.892594 2.812526 4.141756 ] [ 2.634032 3.625436 1.937955 ] [ 4.696761 2.293416 2.137678 ] [ 4.185297 2.165547 4.431715 ] [ 4.453239 5.273552 2.545611 ] [ 3.870361 4.380343 4.592008 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.290406e-10 1.365127e-10 2.478138e-10 ] [ 1.892594e-10 2.812526e-10 4.141756e-10 ] [ 2.634032e-10 3.625436e-10 1.937955e-10 ] [ 4.696761000000001e-10 2.293416e-10 2.137678e-10 ] [ 4.185297000000001e-10 2.165547e-10 4.431715e-10 ] [ 4.453239e-10 5.273551999999999e-10 2.545611e-10 ] [ 3.870361e-10 4.380343e-10 4.592008e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.2942481 -7.5352984 -3.6801954 ] [ -6.4725529 0.6288454 4.6239461 ] [ -3.4306571 5.7385191 -8.5521535 ] [ 4.9052914 -1.7489508 -2.4422864 ] [ 6.4045587 -3.2956395 5.5970462 ] [ 0.6646688 1.327596 -0.5425053 ] [ 2.2229391 4.8849282 4.9961482 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.88014390973482e-09 -1.207287892723165e-08 -5.896323029855705e-09 ] [ -1.037017293327124e-08 1.007521397977624e-09 7.40837833725934e-09 ] [ -5.496518599601528e-09 9.194121140034258e-09 -1.370206039519289e-08 ] [ 7.859143199291302e-09 -2.802128082689457e-09 -3.912974171377797e-09 ] [ 1.026123421568124e-08 -5.280196557485002e-09 8.967456567177482e-09 ] [ 1.064916811935191e-09 2.127043273067597e-09 -8.691893083200903e-10 ] [ 3.561541055482193e-09 7.826517756326627e-09 8.004711840092004e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.3089617 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.903717695662624e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.5546173 1.2631574 2.5948134 ] [ 1.5696706 3.1695784 3.6693436 ] [ 2.0036267 4.625694 1.7708727 ] [ 4.8078493 2.0571233 2.3673685 ] [ 5.1318898 2.2149334 4.7721271 ] [ 4.3678285 4.494491 2.3176132 ] [ 3.5872078 4.0909695 4.7727226 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5546173e-10 1.2631574e-10 2.5948134e-10 ] [ 1.5696706e-10 3.1695784e-10 3.6693436e-10 ] [ 2.0036267e-10 4.625694000000001e-10 1.7708727e-10 ] [ 4.8078493e-10 2.0571233e-10 2.3673685e-10 ] [ 5.1318898e-10 2.2149334e-10 4.7721271e-10 ] [ 4.3678285e-10 4.494491e-10 2.3176132e-10 ] [ 3.5872078e-10 4.0909695e-10 4.7727226e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.7e-06 3.2e-06 9e-07 ] [ 1.81e-05 4.1e-06 5.3e-06 ] [ 1.64e-05 -2.72e-05 -1.14e-05 ] [ 2e-06 -5.9e-06 -2.88e-05 ] [ -2.8e-06 -1.85e-05 2.4e-06 ] [ -1.41e-05 1.74e-05 3.4e-06 ] [ -1.18e-05 2.7e-05 2.81e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.233675998016e-14 5.126965186560001e-15 1.44195895872e-15 ] [ 2.899939683648e-14 6.568924145279999e-15 8.491536090240001e-15 ] [ 2.627569658112e-14 -4.357920408576e-14 -1.826481347712e-14 ] [ 3.2043532416e-15 -9.45284206272e-15 -4.614268667904e-14 ] [ -4.48609453824e-15 -2.96402674848e-14 3.84522388992e-15 ] [ -2.259069035328e-14 2.787787320192e-14 5.44740051072e-15 ] [ -1.890568412544e-14 4.32587687616e-14 4.502116304448e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.129296 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.783109785716296e-18 } }