{ "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" [ [ 2.735268 2.856882 0.3239211 ] [ 1.752307 5.080999 1.048158 ] [ 2.257155 3.165316 3.087528 ] [ 4.821596 2.368521 1.002197 ] [ 4.597336 2.893151 3.290106 ] [ 3.849033 4.748793 0.5493667 ] [ 3.5339 4.902962 2.909562 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.735268e-10 2.856882e-10 3.239211e-11 ] [ 1.752307e-10 5.080999e-10 1.048158e-10 ] [ 2.257155e-10 3.165316e-10 3.087528e-10 ] [ 4.821596000000001e-10 2.368521e-10 1.002197e-10 ] [ 4.597336e-10 2.893151e-10 3.290106e-10 ] [ 3.849033e-10 4.748793e-10 5.493667e-11 ] [ 3.5339e-10 4.902962e-10 2.909562e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.5860113 -6.831293 -3.7207588 ] [ -7.7679305 4.8867589 -1.8419355 ] [ -5.8264147 -4.7421902 3.3424674 ] [ 3.7815334 -3.1878689 0.4679834 ] [ 4.1541361 -3.2199384 1.430636 ] [ 6.0527125 6.1480519 -4.2288611 ] [ 3.1919746 6.9464796 4.5504686 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.745423466784615e-09 -1.094493793443469e-08 -5.961312760995863e-09 ] [ -1.244559663909925e-08 7.829450861066326e-09 -2.951105995121559e-09 ] [ -9.334945415425447e-09 -7.597826269826875e-09 5.355223124066162e-09 ] [ 6.058684404254334e-09 -5.107529021755413e-09 7.497920624024947e-10 ] [ 6.65565973904129e-09 -5.15891002489616e-09 2.292131552074829e-09 ] [ 9.697514459923921e-09 9.850265017645019e-09 -6.77538238703057e-09 ] [ 5.114107078307432e-09 1.112948721198414e-08 7.290654404604508e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -2.7670571 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.433314194038648e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.1088092 2.5008038 0.7312127 ] [ 1.8722801 4.8599537 0.2591549 ] [ 2.0442515 2.2834096 3.1380709 ] [ 4.5670972 2.8055151 0.8570805 ] [ 4.3607646 2.9492781 3.3245992 ] [ 4.2067437 5.2569858 0.7460647 ] [ 4.3866486 5.3606778 3.1546558 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1088092e-10 2.5008038e-10 7.312127000000001e-11 ] [ 1.8722801e-10 4.8599537e-10 2.591549e-11 ] [ 2.0442515e-10 2.2834096e-10 3.1380709e-10 ] [ 4.5670972e-10 2.8055151e-10 8.570805e-11 ] [ 4.360764600000001e-10 2.9492781e-10 3.3245992e-10 ] [ 4.2067437e-10 5.2569858e-10 7.460647e-11 ] [ 4.3866486e-10 5.3606778e-10 3.1546558e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.1e-05 -2.42e-05 4.9e-06 ] [ 1.45e-05 5.01e-05 -3.18e-05 ] [ -1.48e-05 -2.71e-05 2.97e-05 ] [ 1.83e-05 -1.39e-05 -1.61e-05 ] [ 2.67e-05 -2.03e-05 1.86e-05 ] [ -9.5e-06 1.52e-05 6.3e-06 ] [ -1.42e-05 2.03e-05 -1.16e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.36457090368e-14 -3.877267422336e-14 7.850665441919999e-15 ] [ 2.32315610016e-14 8.026904870208e-14 -5.094921654144e-14 ] [ -2.371221398784e-14 -4.341898642368e-14 4.758464563776e-14 ] [ 2.931983216064e-14 -2.227025502912e-14 -2.579504359488e-14 ] [ 4.277811577536e-14 -3.252418540224e-14 2.980048514688e-14 ] [ -1.52206778976e-14 2.435308463616e-14 1.009371271104e-14 ] [ -2.275090801536e-14 3.252418540224e-14 -1.858524880128e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.267203 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.805204922840762e-18 } }