{ "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" [ [ 1.302275 0.3737398 2.647818 ] [ 0.2826825 1.480501 1.727575 ] [ 0.6414777 2.53008 2.452953 ] [ 2.763361 0.4669357 0.177905 ] [ 2.062003 2.101671 0.3497139 ] [ 2.601995 2.989286 1.853157 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.302275e-10 3.737398e-11 2.647818e-10 ] [ 2.826825e-11 1.480501e-10 1.727575e-10 ] [ 6.414777000000001e-11 2.53008e-10 2.452953e-10 ] [ 2.763361e-10 4.669357e-11 1.77905e-11 ] [ 2.062003e-10 2.101671e-10 3.497139e-11 ] [ 2.601995e-10 2.989286e-10 1.853157e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 15.7390036 -31.6621301 11.7238747 ] [ -48.1142477 -57.6941577 -42.2035874 ] [ 13.2696034 82.5827566 44.1065275 ] [ 5.3688236 -12.6854177 -2.5860195 ] [ 6.8005837 9.7309555 -21.3585391 ] [ 6.9362333 9.7279933 10.3177437 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.521666360260703e-08 -5.072832461094796e-08 1.878371794952861e-08 ] [ -7.708752279232017e-08 -9.24362306236883e-08 -6.761760104616946e-08 ] [ 2.126024833476819e-08 1.323121619057369e-07 7.066644718517227e-08 ] [ 8.60180365311929e-09 -2.032427966402251e-08 -4.143259983832906e-09 ] [ 1.089573621193356e-08 1.559070940014517e-08 -3.422015200046268e-08 ] [ 1.111307082967443e-08 1.558596343255904e-08 1.653084773554649e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 24.639491 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.947681642861202e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.0252612 -0.985423 2.8364887 ] [ -0.2517006 1.1739418 3.1603166 ] [ 0.5424443 3.1686831 2.6740738 ] [ 3.7031227 0.4150317 -0.7574517 ] [ 3.4419125 2.4711474 -0.0198954 ] [ 2.1927541 3.6988325 1.3155899 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.52612e-12 -9.854230000000001e-11 2.8364887e-10 ] [ -2.517006e-11 1.1739418e-10 3.1603166e-10 ] [ 5.424443e-11 3.1686831e-10 2.6740738e-10 ] [ 3.7031227e-10 4.150317e-11 -7.574517e-11 ] [ 3.4419125e-10 2.4711474e-10 -1.98954e-12 ] [ 2.1927541e-10 3.6988325e-10 1.3155899e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.100172 0.0282387 0.0764532 ] [ -0.0707524 -0.1056741 0.0731677 ] [ 0.0957783 0.0091583 -0.0687891 ] [ 0.1194144 -0.0717244 -0.1160434 ] [ -0.0812057 0.18492 0.091624 ] [ 0.0369374 -0.0449185 -0.0564125 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.604932364587776e-10 4.524338494178496e-11 1.224915296253466e-10 ] [ -1.133578411454899e-10 -1.693085724440813e-10 1.172275783377082e-10 ] [ 1.534537530399686e-10 1.467321414627264e-11 -1.102122877858733e-10 ] [ 1.913229598668595e-10 -1.149151568209075e-10 -1.859220224781427e-10 ] [ -1.301058740156986e-10 2.96274500718336e-10 1.467978307041792e-10 ] [ 5.918023871313792e-11 -7.19673705414048e-11 -9.038278862087999e-11 ] ] } "relaxed-potential-energy" { "source-value" -13.561574 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.172803680404914e-18 } }