{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.487281 5.921696 4.58109 ] [ 2.384555 3.657598 3.132891 ] [ 3.419185 2.494172 4.950415 ] [ 4.429689 2.154563 3.12196 ] [ 4.178368 4.562199 4.289341 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.487281e-10 5.921696e-10 4.58109e-10 ] [ 2.384555e-10 3.657598e-10 3.132891e-10 ] [ 3.419185e-10 2.494172e-10 4.950414999999999e-10 ] [ 4.429689e-10 2.154563e-10 3.12196e-10 ] [ 4.178368e-10 4.562199e-10 4.289341000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0036664 0.4621078 -0.061997 ] [ -2.1305327 0.4471212 -1.4416815 ] [ -1.0763431 -0.713764 3.3897116 ] [ 1.7463228 -1.4887882 -2.7720269 ] [ 2.4642194 1.2933232 0.8859938 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.608050841162501e-09 7.403783134493223e-10 -9.93301439597376e-11 ] [ -3.4134896817899e-09 7.163671333040409e-10 -2.309828393939875e-09 ] [ -1.724491750779397e-09 -1.143575993568691e-09 5.430916676774561e-09 ] [ 2.797917562529994e-09 -2.385301647362914e-09 -4.4412766914087e-09 ] [ 3.948114711201804e-09 2.072132194178242e-09 1.419518552533751e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.6372435 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.383838960385677e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6929483 5.5934323 3.9783002 ] [ 1.9741009 3.417798 3.3062149 ] [ 3.2261094 2.4784978 5.2424841 ] [ 4.3516963 2.85138 2.8316555 ] [ 4.6542231 4.44912 4.7170423 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6929483e-10 5.5934323e-10 3.9783002e-10 ] [ 1.9741009e-10 3.417798e-10 3.3062149e-10 ] [ 3.2261094e-10 2.4784978e-10 5.242484100000001e-10 ] [ 4.351696300000001e-10 2.85138e-10 2.8316555e-10 ] [ 4.6542231e-10 4.44912e-10 4.717042300000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.89e-05 -3e-07 -8e-07 ] [ 1.66e-05 2.04e-05 -7.4e-06 ] [ 2e-07 -5e-06 1.14e-05 ] [ -3.3e-06 -5.2e-06 3.5e-06 ] [ 1.53e-05 -9.9e-06 -6.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.630290434112001e-14 -4.8065298624e-16 -1.28174129664e-15 ] [ 2.659613190528e-14 3.268440306432e-14 -1.185610699392e-14 ] [ 3.2043532416e-16 -8.010883104e-15 1.826481347712e-14 ] [ -5.28718284864e-15 -8.33131842816e-15 5.6076181728e-15 ] [ 2.451330229824e-14 -1.586154854592e-14 -1.057436569728e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.393797 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.665269855474118e-18 } }