{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.336271 1.731327 1.289714 ] [ 2.769645 4.287083 1.737277 ] [ 4.480326 1.077167 0.108092 ] [ 5.392167 2.307543 2.197028 ] [ 3.12468 2.46702 3.187134 ] [ 4.416093 3.533887 0.3236582 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.336271e-10 1.731327e-10 1.289714e-10 ] [ 2.769645e-10 4.287083e-10 1.737277e-10 ] [ 4.480326e-10 1.077167e-10 1.08092e-11 ] [ 5.392167e-10 2.307543e-10 2.197028e-10 ] [ 3.12468e-10 2.467020000000001e-10 3.187134e-10 ] [ 4.416093e-10 3.533887e-10 3.236582e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.6263623 -3.5344461 -1.9129157 ] [ -0.1842373 2.3469126 -0.2427321 ] [ -0.9118734 -0.426845 0.1909496 ] [ -0.2139412 -0.1475994 1.0620737 ] [ 1.7213431 -0.1111374 1.9621093 ] [ 1.2150712 1.8731152 -1.0594847 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.605719654010516e-09 -5.662806908897739e-09 -3.064828812101267e-09 ] [ -2.951806947393158e-10 3.760168498780942e-09 -3.888996957376877e-10 ] [ -1.460982242609407e-09 -6.83881079705376e-10 3.059349848711116e-10 ] [ -3.42771588865897e-10 -2.364803079241075e-10 1.701629651706553e-09 ] [ 2.757895671195396e-09 -1.780617439764979e-10 3.143645647914254e-09 ] [ 1.946758669247401e-09 3.001061381505116e-09 -1.697481616435302e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.8886835 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.584341751419072e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3925682 1.1563342 1.3001595 ] [ 3.1486721 4.4816666 1.7781345 ] [ 4.4860853 1.5632066 0.3456251 ] [ 5.2578693 1.8656293 2.5302009 ] [ 3.0876925 2.5831527 3.0149488 ] [ 4.1462945 3.7540376 -0.1261656 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3925682e-10 1.1563342e-10 1.3001595e-10 ] [ 3.148672100000001e-10 4.4816666e-10 1.7781345e-10 ] [ 4.4860853e-10 1.5632066e-10 3.456251e-11 ] [ 5.257869300000001e-10 1.8656293e-10 2.5302009e-10 ] [ 3.0876925e-10 2.5831527e-10 3.0149488e-10 ] [ 4.1462945e-10 3.7540376e-10 -1.261656e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.6e-06 7.5e-06 1.42e-05 ] [ 1.8e-06 1.48e-05 -9.7e-06 ] [ 5.8e-06 -9.5e-06 -3.19e-05 ] [ 1.97e-05 -7.6e-06 2.01e-05 ] [ -2.08e-05 -8.2e-06 -6e-07 ] [ -9e-06 3e-06 7.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.16565921408e-15 1.2016324656e-14 2.275090801536e-14 ] [ 2.88391791744e-15 2.371221398784e-14 -1.554111322176e-14 ] [ 9.292624400640001e-15 -1.52206778976e-14 -5.110943420352001e-14 ] [ 3.156287942976e-14 -1.217654231808e-14 3.220375007808e-14 ] [ -3.332527371264e-14 -1.313784829056e-14 -9.6130597248e-16 ] [ -1.44195895872e-14 4.8065298624e-15 1.249697764224e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.433831 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.831901671437829e-18 } }