{ "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" [ [ 2.04098 2.133134 3.812884 ] [ 2.161605 4.797503 2.926814 ] [ 2.748178 3.149118 1.513672 ] [ 4.833213 2.247647 2.725743 ] [ 4.087134 1.710162 4.852625 ] [ 4.720686 4.556589 2.507622 ] [ 3.429181 3.830938 4.469304 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.04098e-10 2.133134e-10 3.812884e-10 ] [ 2.161605e-10 4.797503e-10 2.926814e-10 ] [ 2.748178e-10 3.149118e-10 1.513672e-10 ] [ 4.833213e-10 2.247647e-10 2.725743e-10 ] [ 4.087134e-10 1.710162e-10 4.852625e-10 ] [ 4.720686e-10 4.556589e-10 2.507622e-10 ] [ 3.429181e-10 3.830938e-10 4.469304000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -12.6536637 -6.4309537 -5.5627973 ] [ -11.8611162 10.8796806 -0.801026 ] [ -0.8382938 -8.0796628 -7.2477305 ] [ 3.5036438 -5.8507298 -4.3841342 ] [ 7.9846949 -12.35018 8.0132857 ] [ 6.4317894 6.5645931 0.4831178 ] [ 7.4329456 15.2672525 9.4992845 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.027340414760562e-08 -1.030352366758726e-08 -8.912583780309364e-09 ] [ -1.900360307223214e-08 1.743116989909132e-08 -1.283385129852941e-09 ] [ -1.343094727721591e-09 -1.294504684210747e-08 -1.16121443609591e-08 ] [ 5.613456183970871e-09 -9.373902500177859e-09 -7.024157317689711e-09 ] [ 1.2792891493001e-08 -1.978716965867174e-08 1.283869900433097e-08 ] [ 1.030486260658926e-08 1.0517637589885e-08 7.740400442523302e-10 ] [ 1.190889166399823e-08 2.446083501935035e-08 1.521953154022782e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -14.873683 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.383026716779041e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8310715 2.0186504 3.8840672 ] [ 2.1277462 5.2126981 2.6742742 ] [ 2.7285441 2.8810022 1.6631573 ] [ 5.0970934 2.0215991 2.358227 ] [ 4.2686558 1.6410686 4.7134845 ] [ 4.7305588 4.5655213 2.6868481 ] [ 3.2373071 4.0845513 4.8286057 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8310715e-10 2.0186504e-10 3.8840672e-10 ] [ 2.1277462e-10 5.2126981e-10 2.6742742e-10 ] [ 2.7285441e-10 2.8810022e-10 1.6631573e-10 ] [ 5.0970934e-10 2.0215991e-10 2.358227e-10 ] [ 4.268655800000001e-10 1.6410686e-10 4.7134845e-10 ] [ 4.7305588e-10 4.565521300000001e-10 2.6868481e-10 ] [ 3.2373071e-10 4.0845513e-10 4.8286057e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.03e-05 -1.27e-05 1.38e-05 ] [ -2.56e-05 2.83e-05 8.8e-06 ] [ 3.91e-05 -2.59e-05 9e-07 ] [ -1.72e-05 2.74e-05 4.4e-06 ] [ 6.7e-06 1.18e-05 -2.43e-05 ] [ 3.13e-05 -2.82e-05 -1.26e-05 ] [ -4e-06 -7e-07 9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.854595161024e-14 -2.034764308416e-14 2.211003736704e-14 ] [ -4.101572149248001e-14 4.534159836864e-14 1.409915426304e-14 ] [ 6.264510587328001e-14 -4.149637447872e-14 1.44195895872e-15 ] [ -2.755743787776e-14 4.389963940992e-14 7.04957713152e-15 ] [ 1.073458335936e-14 1.890568412544e-14 -3.893289188544e-14 ] [ 5.014812823104e-14 -4.518138070656001e-14 -2.018742542208e-14 ] [ -6.4087064832e-15 -1.12152363456e-15 1.44195895872e-14 ] ] } "relaxed-potential-energy" { "source-value" -23.755005 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.805971363798711e-18 } }