{ "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" [ [ 1.891577 1.147444 4.176951 ] [ 1.947528 5.315412 2.001915 ] [ 3.037668 3.274696 0.9821769 ] [ 1.344392 3.383525 2.90788 ] [ 3.679276 1.837825 2.704146 ] [ 4.016034 4.351153 3.141989 ] [ 3.129852 3.103182 4.716137 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.891577e-10 1.147444e-10 4.176951e-10 ] [ 1.947528e-10 5.315412000000001e-10 2.001915e-10 ] [ 3.037668e-10 3.274696e-10 9.821769000000001e-11 ] [ 1.344392e-10 3.383525e-10 2.90788e-10 ] [ 3.679276000000001e-10 1.837825e-10 2.704146e-10 ] [ 4.016034e-10 4.351153e-10 3.141989e-10 ] [ 3.129852e-10 3.103182e-10 4.716137e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.4973115 -0.3953642 -0.2931991 ] [ 0.8738174 1.3626769 -0.3068814 ] [ -0.0947363 -0.1200023 -0.8411652 ] [ -1.9789044 -1.3832147 0.9474509 ] [ 1.2011864 -1.4113525 -0.7135063 ] [ 0.9992005 1.6677941 -0.9940739 ] [ -0.503252 0.2794628 2.201375 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.967808585549793e-10 -6.334432779412954e-10 -4.697567432596013e-10 ] [ 1.400009809128242e-09 2.18324907088422e-09 -4.916782044383732e-10 ] [ -1.51784285001095e-10 -1.922648795022278e-10 -1.347695217670556e-09 ] [ -3.170554364478252e-09 -2.216154253886886e-09 1.517983681335919e-09 ] [ 1.924512767302917e-09 -2.261235979207632e-09 -1.143163112653511e-09 ] [ 1.600895680591671e-09 2.672100715328178e-09 -1.592681961927477e-09 ] [ -8.062985887708417e-10 4.477487645433063e-10 3.5269915586136e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.25218 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.603886283303335e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2293357 1.6447798 3.9723068 ] [ 2.9280765 5.2334646 1.9997603 ] [ 2.2216884 3.2329093 1.0854147 ] [ 0.6085098 2.5175558 2.5764419 ] [ 3.7803939 2.1766605 2.3805099 ] [ 4.3418252 4.1182234 3.4471055 ] [ 2.9364975 3.4896437 5.1696557 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2293357e-10 1.6447798e-10 3.9723068e-10 ] [ 2.9280765e-10 5.2334646e-10 1.9997603e-10 ] [ 2.2216884e-10 3.2329093e-10 1.0854147e-10 ] [ 6.085098e-11 2.5175558e-10 2.5764419e-10 ] [ 3.7803939e-10 2.1766605e-10 2.3805099e-10 ] [ 4.3418252e-10 4.1182234e-10 3.4471055e-10 ] [ 2.9364975e-10 3.4896437e-10 5.1696557e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.3e-06 1.12e-05 -1.24e-05 ] [ 2.4e-05 1.04e-05 5.5e-06 ] [ 2.1e-06 -7.2e-06 2.38e-05 ] [ -7.7e-06 -1.52e-05 5.7e-06 ] [ 1.13e-05 -5.3e-06 -2.16e-05 ] [ -1.41e-05 9e-07 -2.09e-05 ] [ -1.33e-05 5.3e-06 1.99e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.68500622784e-15 1.794437815296e-14 -1.986699009792e-14 ] [ 3.84522388992e-14 1.666263685632e-14 8.8119714144e-15 ] [ 3.36457090368e-15 -1.153567166976e-14 3.813180357504e-14 ] [ -1.233675998016e-14 -2.435308463616e-14 9.13240673856e-15 ] [ 1.810459581504e-14 -8.491536090240001e-15 -3.460701500928e-14 ] [ -2.259069035328e-14 1.44195895872e-15 -3.348549137472e-14 ] [ -2.130894905664e-14 8.491536090240001e-15 3.188331475392e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.636824 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.985948369876434e-18 } }