{ "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" [ [ -3.9919252 -2.3722725 0.871739 ] [ -2.4737212 3.307726 -0.7806376 ] [ -1.9824481 -2.3024677 -4.9709764 ] [ 4.457615 -2.1217895 -2.8515123 ] [ 1.1424435 -1.6868065 0.8537972 ] [ 2.6252411 1.2257968 0.0686063 ] [ 0.2227949 3.9498134 6.8089839 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.395769227422364e-09 -3.800799537666768e-09 1.396679845239571e-09 ] [ -3.963338273017321e-09 5.299561265212302e-09 -1.250719312037422e-09 ] [ -3.176231997769381e-09 -3.688959919087148e-09 -7.964382170628549e-09 ] [ 7.141886537527392e-09 -3.399481531158922e-09 -4.568626340983636e-09 ] [ 1.830396266284925e-09 -2.702561938113475e-09 1.367933912744502e-09 ] [ 4.206099914383275e-09 1.963942974811454e-09 1.09919409899591e-10 ] [ 3.569567800134739e-10 6.328298686002559e-09 1.090919481598361e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -14.416407 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.309763025133746e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2484519 1.1728608 3.6174588 ] [ 2.0474059 4.7790689 2.9016699 ] [ 2.4290719 2.7076139 1.8263194 ] [ 4.7329238 2.8317535 1.3037041 ] [ 3.1639764 2.3987677 5.4794637 ] [ 5.6484356 4.0576645 3.1657136 ] [ 3.7507114 4.4773617 4.5143346 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2484519e-10 1.1728608e-10 3.6174588e-10 ] [ 2.0474059e-10 4.779068900000001e-10 2.9016699e-10 ] [ 2.4290719e-10 2.7076139e-10 1.8263194e-10 ] [ 4.7329238e-10 2.8317535e-10 1.3037041e-10 ] [ 3.1639764e-10 2.3987677e-10 5.4794637e-10 ] [ 5.6484356e-10 4.0576645e-10 3.1657136e-10 ] [ 3.7507114e-10 4.4773617e-10 4.5143346e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.21e-05 -1.4e-05 -1.03e-05 ] [ 6e-06 -1.16e-05 -2.6e-06 ] [ -6.3e-06 2.88e-05 2.02e-05 ] [ -2e-06 -9.9e-06 8.5e-06 ] [ -2.6e-06 2.8e-05 -1.13e-05 ] [ -1.48e-05 5.9e-06 6.3e-06 ] [ 7.6e-06 -2.72e-05 -1.08e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.938633711168e-14 -2.24304726912e-14 -1.650241919424e-14 ] [ 9.6130597248e-15 -1.858524880128e-14 -4.16565921408e-15 ] [ -1.009371271104e-14 4.614268667904e-14 3.236396774016e-14 ] [ -3.2043532416e-15 -1.586154854592e-14 1.36185012768e-14 ] [ -4.16565921408e-15 4.48609453824e-14 -1.810459581504e-14 ] [ -2.371221398784e-14 9.45284206272e-15 1.009371271104e-14 ] [ 1.217654231808e-14 -4.357920408576e-14 -1.730350750464e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.442861 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.435525057726411e-18 } }