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| NO | Title, Author(s) (Publication Title, Volume Issue, Page, Issue Date) |
|---|---|
| Advances in methods and algorithms in a modern quantum chemistry program package Shao, Y; Molnar, LF; Jung, Yousung; Kussmann, J; Ochsenfeld, C; Brown, ST; Gilbert, ATB; Slipchenko, LV; Levchenko, SV; O'Neill, DP; DiStasio, RA; Lochan, RC; Wang, T; Beran, GJO; Besley, NA; Herbert, JM; Lin, CY; Van Voorhis, T; Chien, SH; Sodt, A; Steele, RP; Rassolov, VA; Maslen, PE; Korambath, PP; Adamson, RD; Austin, B; Baker, J; Byrd, EFC; Dachsel, H; Doerksen, RJ; Dreuw, A; Dunietz, BD; Dutoi, AD; Furlani, TR; Gwaltney, SR; Heyden, A; Hirata, S; Hsu, CP; Kedziora, G; Khalliulin, RZ; Klunzinger, P; Lee, AM; Lee, MS; Liang, W; Lotan, I; Nair, N; Peters, B; Proynov, EI; Pieniazek, PA; Rhee, Young Min; Ritchie, J; Rosta, E; Sherrill, CD; Simmonett, AC; Subotnik, JE; Woodcock, HL; Zhang, W; Bell, AT; Chakraborty, AK; Chipman, DM; Keil, FJ; Warshel, A; Hehre, WJ; Schaefer, HF; Kong, J; Krylov, AI; Gill, PMW; Head-Gordon, M, PHYSICAL CHEMISTRY CHEMICAL PHYSICS, v.8, no.27, pp.3172 - 3191, 2006 | |
| A fast implementation of perfect pairing and imperfect pairing using the resolution of the identity approximation Sodt, A; Beran, GJO; Jung, Yousung; Austin, B; Head-Gordon, M, JOURNAL OF CHEMICAL THEORY AND COMPUTATION, v.2, no.2, pp.300 - 305, 2006 | |
| Ab initio quantum chemistry calculations on the electronic structure of heavier alkyne congeners: Diradical character and reactivity Jung, Yousung; Brynda, M; Power, PP; Head-Gordon, M, JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, v.128, no.22, pp.7185 - 7192, 2006-06 | |
| A fast correlated electronic structure method for computing interaction energies of large van der Waals complexes applied to the fullerene-porphyrin dimer Jung, Yousung; Head-Gordon, M, PHYSICAL CHEMISTRY CHEMICAL PHYSICS, v.8, no.24, pp.2831 - 2840, 2006 |
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