{ "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" [ [ 0.1837152 1.359189 0.2246076 ] [ 1.439885 0.3143995 0.1278355 ] [ 1.736921 1.45075 1.267781 ] [ 2.492617 0.9019618 2.872525 ] [ 2.597932 2.758406 2.155931 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.837152e-11 1.359189e-10 2.246076e-11 ] [ 1.439885e-10 3.143995e-11 1.278355e-11 ] [ 1.736921e-10 1.45075e-10 1.267781e-10 ] [ 2.492617e-10 9.019618e-11 2.872525e-10 ] [ 2.597932e-10 2.758406e-10 2.155931e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 862.2967971 2233.4285689 2414.3354666 ] [ 2012.6405782 -3794.9392551 -1950.5015493 ] [ -3094.5370677 1419.0281284 -741.7840004 ] [ 66.914768 -151.7449468 185.7747823 ] [ 152.6849244 294.2275046 92.1753009 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.381551768504341e-06 3.578347037318382e-06 3.868191839354779e-06 ] [ 3.224605680465434e-06 -6.080162951877388e-06 -3.125047981122639e-06 ] [ -4.957994942067927e-06 2.273533691580061e-06 -1.188468983124378e-06 ] [ 1.07209276875856e-07 -2.431222060874998e-07 2.976440129352696e-07 ] [ 2.446282162222955e-07 4.714044290664444e-07 1.476811121171852e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 586.15708 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.391271696923953e-17 } "relaxed-configuration-positions" { "source-value" [ [ -0.6077958 1.871023 -0.9691142 ] [ 0.6073575 -1.1518288 -0.4544181 ] [ 1.6788766 1.3863481 1.3248813 ] [ 3.9691876 0.8137155 3.601211 ] [ 2.8034442 3.8654485 3.14612 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.077958e-11 1.871023e-10 -9.691142000000001e-11 ] [ 6.073575e-11 -1.1518288e-10 -4.544181e-11 ] [ 1.6788766e-10 1.3863481e-10 1.3248813e-10 ] [ 3.9691876e-10 8.137155e-11 3.601211e-10 ] [ 2.8034442e-10 3.8654485e-10 3.14612e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.24e-05 1.74e-05 -1.51e-05 ] [ -5.1e-06 1.46e-05 -7.7e-06 ] [ 1.65e-05 -3.62e-05 3.31e-05 ] [ 1.49e-05 1.27e-05 1.29e-05 ] [ -1.38e-05 -8.4e-06 -2.31e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.986699009792e-14 2.787787320192e-14 -2.419286697408e-14 ] [ -8.17110076608e-15 2.339177866368e-14 -1.233675998016e-14 ] [ 2.64359142432e-14 -5.799879367296e-14 5.303204614848e-14 ] [ 2.387243164992e-14 2.034764308416e-14 2.066807840832e-14 ] [ -2.211003736704e-14 -1.345828361472e-14 -3.701027994048e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.225055 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.638234406739414e-18 } }