Showing results 1 to 8 of 8
A fast doubly hybrid density functional method close to chemical accuracy using a local opposite spin ansatz Zhang, IY; Xu, X; Jung, Yousung; Goddard, WA, PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA, v.108, no.50, pp.19896 - 19900, 2011-12 |
An ab initio study of the structure of two-, three- and five-dimer silicon clusters: An approach to the Si(100) surface Jung, Yousung; Akinaga, Y; Jordan, KD; Gordon, MS, THEORETICAL CHEMISTRY ACCOUNTS, v.109, no.5, pp.268 - 273, 2003-06 |
Analytic Derivatives of Quartic-Scaling Doubly Hybrid XYGJ-OS Functional: Theory, Implementation, and Benchmark Comparison with M06-2X and MP2 Geometries for Nonbonded Complexes Ji, Hyunjun; Shao, Yihan; Goddard, William A.; Jung, Yousung, JOURNAL OF CHEMICAL THEORY AND COMPUTATION, v.9, no.4, pp.1971 - 1976, 2013-04 |
Analytical Double-Hybrid Density Functional Based on the Polynomial Series Expansion of Adiabatic Connection: A Quadratic Approximation Kim, Jaehoon; Jung, You-Sung, JOURNAL OF CHEMICAL THEORY AND COMPUTATION, v.11, no.1, pp.45 - 54, 2015-01 |
Cycloaddition of benzene on Si(100) and its surface conversions Jung, Yousung; Gordon, MS, JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, v.127, no.9, pp.3131 - 3139, 2005-03 |
Fast evaluation of scaled opposite spin second-order Moller-Plesset correlation energies using auxiliary basis expansions and exploiting sparsity Jung, Yousung; Shao, YH; Head-Gordon, M, JOURNAL OF COMPUTATIONAL CHEMISTRY, v.28, no.12, pp.1953 - 1964, 2007-09 |
Scaled opposite spin second order Moller-Plesset theory with improved physical description of long-range dispersion interactions Lochan, RC; Jung, Yousung; Head-Gordon, M, JOURNAL OF PHYSICAL CHEMISTRY A, v.109, no.33, pp.7598 - 7605, 2005-08 |
Scaled opposite-spin second order Moller-Plesset correlation energy: An economical electronic structure method Jung, Yousung; Lochan, RC; Dutoi, AD; Head-Gordon, M, JOURNAL OF CHEMICAL PHYSICS, v.121, no.20, pp.9793 - 9802, 2004-11 |
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