{ "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" [ [ 1.442259 2.324158 2.548252 ] [ 2.158618 1.41899 4.605472 ] [ 2.34516 4.213318 2.000238 ] [ 2.029556 3.900131 4.500233 ] [ 3.591834 1.471441 2.657937 ] [ 4.338938 2.513725 4.512162 ] [ 5.128703 3.807673 2.402827 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.442259e-10 2.324158e-10 2.548252e-10 ] [ 2.158618e-10 1.41899e-10 4.605472e-10 ] [ 2.34516e-10 4.213318e-10 2.000238e-10 ] [ 2.029556e-10 3.900131e-10 4.500233e-10 ] [ 3.591834e-10 1.471441e-10 2.657937e-10 ] [ 4.338938e-10 2.513725e-10 4.512162e-10 ] [ 5.128703e-10 3.807673e-10 2.402827e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.4281266 -1.5560185 -0.7744632 ] [ -0.6227022 -0.199109 1.1604677 ] [ 1.5400805 1.6624465 -0.2781326 ] [ 0.2258657 0.4149582 0.538892 ] [ 0.7462892 -1.010081 -2.2252089 ] [ 1.1887559 1.2616396 1.2155071 ] [ -1.6501626 -0.5738358 0.3629379 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.288111050062593e-09 -2.493016462232285e-09 -1.240826832709955e-09 ] [ -9.976789065607256e-10 -3.190077847908673e-10 1.859274218133548e-09 ] [ 2.467480971249974e-09 2.663532915630787e-09 -4.456175492023181e-10 ] [ 3.618767439806265e-10 6.648363266492505e-10 8.634001635361537e-10 ] [ 1.195687108595535e-09 -1.618328163314285e-09 -3.565177675976085e-09 ] [ 1.904596910818063e-09 2.021369470995464e-09 1.947457058036408e-09 ] [ -2.643851938238542e-09 -9.193863029380646e-10 5.814906181822484e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -16.502419 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.643978990844572e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6520846 1.9494194 2.2453717 ] [ 1.4019041 1.8010828 4.5372383 ] [ 2.4526102 4.0688177 2.5450408 ] [ 2.4115037 3.8596737 4.8203554 ] [ 3.8300982 1.2551968 1.911378 ] [ 4.6639665 3.3527198 4.738799 ] [ 4.6229007 3.362526 2.4289378 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6520846e-10 1.9494194e-10 2.2453717e-10 ] [ 1.4019041e-10 1.8010828e-10 4.537238300000001e-10 ] [ 2.4526102e-10 4.0688177e-10 2.5450408e-10 ] [ 2.4115037e-10 3.8596737e-10 4.8203554e-10 ] [ 3.8300982e-10 1.2551968e-10 1.911378e-10 ] [ 4.6639665e-10 3.3527198e-10 4.738799e-10 ] [ 4.6229007e-10 3.362526e-10 2.4289378e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9.2e-06 3.7e-06 2.9e-06 ] [ 5.2e-06 -5.6e-06 -8e-07 ] [ -4.5e-06 8.9e-06 -1.07e-05 ] [ -5.5e-06 2.6e-06 6.6e-06 ] [ 5.1e-06 -8e-06 3.8e-06 ] [ 1.5e-06 -6e-06 2.6e-06 ] [ 7.5e-06 4.4e-06 -4.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.474002491136e-14 5.928053496960001e-15 4.646312200320001e-15 ] [ 8.33131842816e-15 -8.972189076479999e-15 -1.28174129664e-15 ] [ -7.2097947936e-15 1.425937192512e-14 -1.714328984256e-14 ] [ -8.8119714144e-15 4.16565921408e-15 1.057436569728e-14 ] [ 8.17110076608e-15 -1.28174129664e-14 6.08827115904e-15 ] [ 2.4032649312e-15 -9.6130597248e-15 4.16565921408e-15 ] [ 1.2016324656e-14 7.04957713152e-15 -7.04957713152e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.636824 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.985948369876434e-18 } }