{ "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" [ [ 1.931726 1.779285 1.793394 ] [ 2.022352 0.7174538 3.630998 ] [ 4.124201 0.9725878 2.711634 ] [ 3.467636 2.844975 3.645464 ] [ 5.471294 3.704408 2.165903 ] [ 3.262896 3.451778 1.529715 ] [ 3.831227 5.45457 3.339943 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.931726e-10 1.779285e-10 1.793394e-10 ] [ 2.022352e-10 7.174538e-11 3.630998e-10 ] [ 4.124201e-10 9.725878e-11 2.711634e-10 ] [ 3.467636e-10 2.844975e-10 3.645464e-10 ] [ 5.471294000000001e-10 3.704408e-10 2.165903e-10 ] [ 3.262896e-10 3.451778e-10 1.529715e-10 ] [ 3.831227000000001e-10 5.454570000000001e-10 3.339943e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -13.2534843 1.339839 -10.6831601 ] [ -11.4976164 -8.4778794 8.3488183 ] [ 16.8909143 -1.3684344 -4.3984675 ] [ 3.4964611 10.5700973 9.334636 ] [ 1.8818919 3.0920395 1.5676802 ] [ 2.8750234 7.6053918 5.0794171 ] [ -0.39319 -12.7610538 -9.2489239 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.123442268959986e-08 2.146658721436051e-09 -1.711630934848339e-08 ] [ -1.842121219100666e-08 -1.358306016864193e-08 1.33762814915672e-08 ] [ 2.70622279953964e-08 -2.192473602778476e-09 -7.047121795848624e-09 ] [ 5.601948229956651e-09 1.693516277364121e-08 1.495573556287803e-08 ] [ 3.015123205052892e-09 4.953993397490121e-09 2.511700565331069e-09 ] [ 4.606295275732927e-09 1.218518093398403e-08 8.138123324911735e-09 ] [ -6.299598255323519e-10 -2.0445462055131e-08 -1.481840964013836e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -17.338233 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.777891155858305e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2112404 1.6569294 1.5441615 ] [ 1.8850488 1.1785523 3.9968915 ] [ 3.9546734 0.2613385 2.717053 ] [ 3.87945 2.6687197 3.5069495 ] [ 5.5101964 4.1133665 2.1900379 ] [ 3.1224348 3.8527779 1.3739664 ] [ 3.5482882 5.1933733 3.4879913 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2112404e-10 1.6569294e-10 1.5441615e-10 ] [ 1.8850488e-10 1.1785523e-10 3.9968915e-10 ] [ 3.9546734e-10 2.613385e-11 2.717053e-10 ] [ 3.87945e-10 2.6687197e-10 3.5069495e-10 ] [ 5.5101964e-10 4.1133665e-10 2.1900379e-10 ] [ 3.1224348e-10 3.8527779e-10 1.3739664e-10 ] [ 3.5482882e-10 5.193373300000001e-10 3.4879913e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.15e-05 2.97e-05 0.0001409 ] [ 0.0001045 1.43e-05 -9.29e-05 ] [ -0.0002121 0.0001484 3.15e-05 ] [ 4.09e-05 3.7e-06 -8.99e-05 ] [ -3.23e-05 0.0001081 7.53e-05 ] [ 1.08e-05 -2.35e-05 8.97e-05 ] [ -3.2e-06 -0.0002807 -0.0001547 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.465991608032e-13 4.758464563776e-14 2.2574668587072e-13 ] [ 1.674274568736e-13 2.291112567744e-14 -1.4884220807232e-13 ] [ -3.3982166127168e-13 2.3776301052672e-13 5.04685635552e-14 ] [ 6.552902379072e-14 5.928053496960001e-15 -1.4403567820992e-13 ] [ -5.175030485184e-14 1.7319529270848e-13 1.2064389954624e-13 ] [ 1.730350750464e-14 -3.76511505888e-14 1.4371524288576e-13 ] [ -5.126965186560001e-15 -4.4973097745856e-13 -2.4785672323776e-13 ] ] } "relaxed-potential-energy" { "source-value" -24.356504 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.902342127322169e-18 } }