{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.2203378e-10 2.3676072e-10 2.2394066e-10 ] [ 4.331280900000001e-10 1.7638294e-10 2.0272548e-10 ] [ 5.4046409e-10 2.1990732e-10 3.9044923e-10 ] [ 3.3061104e-10 1.4662083e-10 3.9572304e-10 ] [ 5.6156266e-10 3.552523e-10 2.1532622e-10 ] [ 3.6477304e-10 3.6561735e-10 1.1238452e-10 ] [ 3.746209e-10 3.5328879e-10 3.3238765e-10 ] ] "source-value" [ [ 2.2203378 2.3676072 2.2394066 ] [ 4.3312809 1.7638294 2.0272548 ] [ 5.4046409 2.1990732 3.9044923 ] [ 3.3061104 1.4662083 3.9572304 ] [ 5.6156266 3.552523 2.1532622 ] [ 3.6477304 3.6561735 1.1238452 ] [ 3.746209 3.5328879 3.3238765 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -2.585079934128384e-11 -3.181345985325312e-11 -2.7545421553104e-11 ] [ -1.97932899733632e-12 3.24665070438912e-12 1.08915966681984e-11 ] [ -4.67419007352192e-11 1.662082004651712e-11 -2.607478363287168e-11 ] [ 1.858701119556288e-11 2.279961418463232e-11 5.49210123844032e-12 ] [ -1.653350142068352e-11 -4.761508699355521e-12 9.51500651560704e-12 ] [ 6.3862760105088e-12 1.0690523502288e-11 -7.85066544192e-14 ] [ 6.613208307078912e-11 -1.678263988521792e-11 2.78001676358112e-11 ] ] "source-value" [ [ -0.0161348 -0.0198564 -0.0171925 ] [ -0.0012354 0.0020264 0.006798 ] [ -0.029174 0.0103739 -0.0162746 ] [ 0.0116011 0.0142304 0.0034279 ] [ -0.0103194 -0.0029719 0.0059388 ] [ 0.003986 0.0066725 -4.9e-05 ] [ 0.0412764 -0.0104749 0.0173515 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -8.383886323741434e-18 "source-value" -52.328103 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 6.065506151870377e-09 -5.986167487131996e-09 -3.146582597877842e-09 ] [ -6.6252005990856e-10 -3.857651813749884e-09 1.517158095744987e-08 ] [ -9.898586824746012e-09 2.246859167736207e-09 -1.144597477295048e-08 ] [ 5.059871316863745e-09 1.007708772533427e-08 -8.272044141679221e-09 ] [ -9.791750162882499e-09 -3.096377592376764e-09 4.810378771296148e-09 ] [ -3.96209418287127e-09 3.894669944355806e-09 -3.879392068752843e-09 ] [ 1.318957360145655e-08 -3.27841994416764e-09 6.762033852514376e-09 ] ] "source-value" [ [ 3.7857912 -3.7362719 -1.9639424 ] [ -0.4135125 -2.4077569 9.4693561 ] [ -6.178212 1.4023792 -7.1440156 ] [ 3.1581233 6.2896235 -5.1630039 ] [ -6.1115298 -1.9326069 3.0024023 ] [ -2.4729447 2.4308618 -2.4213261 ] [ 8.2322844 -2.0462288 4.2205296 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.813660970152797e-18 "source-value" -36.286018 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.888839e-10 2.682802e-10 2.483288e-10 ] [ 4.584027e-10 1.697115e-10 1.780244e-10 ] [ 5.622084000000001e-10 2.160801e-10 4.094107000000001e-10 ] [ 3.250182e-10 9.950144e-11 3.979579e-10 ] [ 5.691266e-10 3.575432e-10 2.207922e-10 ] [ 3.710937e-10 3.502612e-10 1.042458e-10 ] [ 3.524601e-10 3.924526e-10 3.14177e-10 ] ] "source-value" [ [ 1.888839 2.682802 2.483288 ] [ 4.584027 1.697115 1.780244 ] [ 5.622084 2.160801 4.094107 ] [ 3.250182 0.9950144 3.979579 ] [ 5.691266 3.575432 2.207922 ] [ 3.710937 3.502612 1.042458 ] [ 3.524601 3.924526 3.14177 ] ] } "instance-id" 1 }