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Showing results 1 to 9 of 9

	Title	Author(s)	Issue Date
	A general second order complete active space self-consistent-field solver for large-scale systems Journal:Chemical Physics Letters	Sun, QM Yang, J Chan, GKL	2017
	Ab initio determination of the crystalline benzene lattice energy to sub-kilojoule/mole accuracy Journal:Science	Yang, J Hu, W Usvyat, D Matthews, D Schütz, M Chan, GKL	2014
	Advances in molecular quantum chemistry contained in the Q-Chem 4 program package Journal:Molecular Physics	Shao, Y Gan, Z Epifanovsky, E Gilbert, ATB Wormit, M Kussmann, J Lange, AW Behn, A Deng, J Feng, X Ghosh, D Stein, T Stück, D Su, YC Thom, AJW Tsuchimochi, T Vanovschi, V Vogt, L Vydrov, O Wang, T Watson, MA Goldey, M Wenzel, J White, A Williams, CF Yang, J Yeganeh, S Yost, SR You, ZQ Zhang, IY Zhang, X Zhao, Y Horn, PR Brooks, BR Chan, GKL Chipman, DM Cramer, CJ Goddard, WA Gordon, MS Hehre, WJ Klamt, A Schaefer, HF Schmidt, MW Jacobson, LD Sherrill, CD Truhlar, DG Warshel, A Xu, X Aspuru-Guzik, A Baer, R Bell, AT Besley, NA Chai, JD Dreuw, A Kaliman, I Dunietz, BD Furlani, TR Gwaltney, SR Hsu, CP Jung, Y Kong, J Lambrecht, DS Liang, W Ochsenfeld, C Rassolov, VA Khaliullin, RZ Slipchenko, LV Subotnik, JE Van Voorhis, T Herbert, JM Krylov, AI Gill, PMW Head-Gordon, M Kus̈, T Landau, A Liu, J Proynov, EI Rhee, YM Richard, RM Rohrdanz, MA Steele, RP Sundstrom, EJ Woodcock, HL Zimmerman, PM Zuev, D Albrecht, B Alguire, E Austin, B Beran, GJO Bernard, YA Berquist, E Brandhorst, K Bravaya, KB Brown, ST Casanova, D Chang, CM Chen, Y Chien, SH Closser, KD Crittenden, DL Diedenhofen, M Distasio, RA Do, H Dutoi, AD Edgar, RG Fatehi, S Fusti-Molnar, L Ghysels, A Golubeva-Zadorozhnaya, A Gomes, J Hanson-Heine, MWD Harbach, PHP Hauser, AW Hohenstein, EG Holden, ZC Jagau, TC Ji, H Kaduk, B Khistyaev, K Kim, J Kim, J King, RA Klunzinger, P Kosenkov, D Kowalczyk, T Krauter, CM Lao, KU Laurent, AD Lawler, KV Levchenko, SV Lin, CY Liu, F Livshits, E Lochan, RC Luenser, A Manohar, P Manzer, SF Mao, SP Mardirossian, N Marenich, AV Maurer, SA Mayhall, NJ Neuscamman, E Oana, CM Olivares-Amaya, R Oneill, DP Parkhill, JA Perrine, TM Peverati, R Prociuk, A Rehn, DR Rosta, E Russ, NJ Sharada, SM Sharma, S Small, DW Sodt, A	2015
	Old problems: Multicentre transition metal chemistry, organic excited states, molecular crystal binding energies, and current limits of ab initio quantum methods Proceeding/Conference:Abstracts Of Papers Of The American Chemical Society	Chan, GKL Sharma, S Yang, J Watson, M	2012
	Optimization of orbital-specific virtuals in local Mller-Plesset perturbation theory Journal:Journal of Chemical Physics	Kurashige, Y Yang, J Chan, GKL Manby, FR	2012
	Recent Developments in the Pyscf Program Package Journal:The Journal of Chemical Physics	Sun, Q Zhang, X Banerjee, S Bao, P Barbry, M Blunt, NS Bogdanov, NA Booth, GH Chen, J Cui, ZH Eriksen, JJ Gao, Y Guo, S Hermann, J Hermes, MR Koh, K Koval, P Lehtola, S Li, Z Liu, J Mardirossian, N McClain, JD Motta, M Mussard, B Pham, HQ Pulkin, A Purwanto, W Robinson, PJ Ronca, E Sayfutyarova, ER Scheurer, M Schurkus, HF Smith, JET Sun, C Sun, SN Upadhyay, S Wagner, LK Wang, X White, A Whitfield, JD Williamson, MJ Wouters, S Yang, J Yu, JM Zhu, T Berkelbach, TC Sharma, S Sokolov, AY Chan, GKL	2020
	Tensor factorizations of local second-order Mller-Plesset theory Journal:Journal of Chemical Physics	Yang, J Kurashige, Y Manby, FR Chan, GKL	2011
	The orbital-specific virtual local triples correction: OSV-L(T) Journal:Journal of Chemical Physics	Schütz, M Yang, J Chan, GKL Manby, FR Werner, HK	2013
	The orbital-specific-virtual local coupled cluster singles and doubles method Journal:Journal of Chemical Physics	Yang, J Chan, GKL Manby, FR Schütz, M Werner, HJ	2012

Showing results 1 to 9 of 9