{ "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" [ [ 1.971858 1.613185 3.540739 ] [ 1.980532 3.696797 1.101352 ] [ 1.421419 3.841396 3.166588 ] [ 2.933735 5.314328 3.389927 ] [ 3.610376 2.128489 1.767833 ] [ 4.452161 4.502678 1.60274 ] [ 4.038762 3.260824 3.402783 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.971858e-10 1.613185e-10 3.540739e-10 ] [ 1.980532e-10 3.696797e-10 1.101352e-10 ] [ 1.421419e-10 3.841396e-10 3.166588e-10 ] [ 2.933735e-10 5.314328e-10 3.389927e-10 ] [ 3.610376e-10 2.128489e-10 1.767833e-10 ] [ 4.452161e-10 4.502678000000001e-10 1.60274e-10 ] [ 4.038762e-10 3.260824e-10 3.402783e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.9209789 -5.1847191 3.270179 ] [ -6.6770574 0.5775487 -12.7316067 ] [ -13.3073307 2.1799409 4.5096693 ] [ 1.1834239 9.7698528 5.2503101 ] [ 2.6751155 -11.9609716 -8.7939616 ] [ 5.9727123 6.880077 -6.3876331 ] [ 13.0741153 -2.2617288 14.8830431 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.679924103430101e-09 -8.306835727435217e-09 5.239404339631124e-09 ] [ -1.069782526201963e-08 9.25335024513433e-10 -2.039828259996064e-08 ] [ -2.13206941327941e-08 3.492650344705711e-09 7.225286719999501e-09 ] [ 1.896054105075957e-09 1.565302974481742e-08 8.41192409417011e-09 ] [ 4.286007512039703e-09 -1.916358905957277e-08 -1.408947967973296e-08 ] [ 9.569340009824597e-09 1.10230985187038e-08 -1.023411641506823e-08 ] [ 2.094704187130358e-08 -3.623689005950039e-09 2.384526370117876e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -7.5153848 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.204097382287568e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9088635 1.817474 3.8023846 ] [ 2.3239112 3.5634324 0.7600674 ] [ 1.2463549 3.9531536 2.921227 ] [ 3.338876 5.0391214 3.5736413 ] [ 3.5051598 1.7244598 1.7434441 ] [ 3.7940175 5.3920754 1.2474859 ] [ 4.2916601 2.8679804 3.9237117 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9088635e-10 1.817474e-10 3.8023846e-10 ] [ 2.3239112e-10 3.5634324e-10 7.600674e-11 ] [ 1.2463549e-10 3.9531536e-10 2.921227e-10 ] [ 3.338876e-10 5.0391214e-10 3.5736413e-10 ] [ 3.5051598e-10 1.7244598e-10 1.7434441e-10 ] [ 3.7940175e-10 5.3920754e-10 1.2474859e-10 ] [ 4.2916601e-10 2.8679804e-10 3.923711700000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3e-07 -3.46e-05 1.14e-05 ] [ -8.4e-06 -8e-07 -3.5e-06 ] [ 9.7e-06 9.3e-06 -1.55e-05 ] [ 4.1e-06 1.44e-05 9.8e-06 ] [ -5.3e-06 -9.4e-06 1.74e-05 ] [ 7.1e-06 2.35e-05 -7.9e-06 ] [ -7e-06 -2.4e-06 -1.16e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.8065298624e-16 -5.543531107968001e-14 1.826481347712e-14 ] [ -1.345828361472e-14 -1.28174129664e-15 -5.6076181728e-15 ] [ 1.554111322176e-14 1.490024257344e-14 -2.48337376224e-14 ] [ 6.568924145279999e-15 2.307134333952e-14 1.570133088384e-14 ] [ -8.491536090240001e-15 -1.506046023552e-14 2.787787320192e-14 ] [ 1.137545400768e-14 3.76511505888e-14 -1.265719530432e-14 ] [ -1.12152363456e-14 -3.84522388992e-15 -1.858524880128e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.875973 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.864046601465204e-18 } }