Binding energies, molecular structures, and vibrational frequencies of transition metal carbonyls using density functional theory with gradient corrections B Delley, M Wrinn, HP Lüthi The Journal of chemical physics 100 (8), 5785-5791, 1994 | 276 | 1994 |
Comparison of local‐density and Hartree–Fock calculations of molecular polarizabilities and hyperpolarizabilities J Guan, P Duffy, JT Carter, DP Chong, KC Casida, ME Casida, M Wrinn The Journal of chemical physics 98 (6), 4753-4765, 1993 | 184 | 1993 |
Parallel programming: can we PLEASE get it right this time? T Mattson, M Wrinn Proceedings of the 45th annual design automation conference, 7-11, 2008 | 49 | 2008 |
A density functional study of chemical reactions J Andzelm, J Baker, A Scheiner, M Wrinn International Journal of Quantum Chemistry 56 (6), 733-746, 1995 | 34 | 1995 |
Electron affinities for rare gases and some actinides from local-spin-density-functional theory Y Guo, MC Wrinn, MA Whitehead Physical Review A 40 (11), 6685, 1989 | 22 | 1989 |
Parallel implementation of a mesh‐based density functional electronic structure code YS Li, MC Wrinn, JM Newsam, MP Sears Journal of Computational Chemistry 16 (2), 226-234, 1995 | 13 | 1995 |
Preparing students for ubiquitous parallelism D Ernst, B Wittman, B Harvey, T Murphy, M Wrinn Proceedings of the 40th ACM technical symposium on Computer science …, 2009 | 8 | 2009 |
Density functional calculations on agostic ethyl-Ti (IV) complexes H Munakata, Y Ebisawa, Y Takashima, MC Wrinn, AC Scheiner, ... Catalysis today 23 (4), 403-408, 1995 | 7 | 1995 |
The Berkeley Par Lab: Progress in the Parallel Computing Landscape D Patterson, D Gannon, M Wrinn Microsoft Corporation, 96, 2013 | 6 | 2013 |
Top 10 challenges in parallel computing M Wrinn Intel, 2009 | 6 | 2009 |
Adapting computing curricula to a multicore world R LeBlanc, M Wrinn 2010 IEEE Frontiers in Education Conference (FIE), T3J-1, 2010 | 4 | 2010 |
Electronic structure, ultraviolet transition energies and quadrupole couplings of the planar heterocycles 2, 1, 3-benzoxadiazole, 2, 1, 3-benzothiadiazole and 2, 1, 3 … MC Wrinn, MA Whitehead Journal of the Chemical Society, Faraday Transactions 88 (18), 2641-2647, 1992 | 4 | 1992 |
Electronic structure and quadrupole couplings of the heterocycles 2-imidazolidinone, 2-imidazolidinethione and 2-imidazolidineselenone by the MS-LDA method MC Wrinn, MA Whitehead Journal of the Chemical Society, Faraday Transactions 86 (6), 889-897, 1990 | 4 | 1990 |
Suddenly, all computing is parallel: seizing opportunity amid the clamor M Wrinn Proceedings of the 41st ACM technical symposium on Computer science …, 2010 | 3 | 2010 |
Concurrency and parallelism in the computing ontology L Cassel, R LeBlanc, A McGettrick, M Wrinn ACM SIGCSE Bulletin 41 (3), 402-402, 2009 | 3 | 2009 |
Density functional methods as computational tools in materials design YS Li, MA van Daelen, M Wrinn, D King-Smith, JM Newsam, B Delley, ... Journal of Computer-Aided Materials Design 1, 199-214, 1994 | 3 | 1994 |
Effect of correlation and orbital-dependent generalized exchange on the equilibrium geometry of the H 2 O molecule in the LCGTO-LDA method MC Wrinn, MA Whitehead Journal of the Chemical Society, Faraday Transactions 88 (18), 2635-2639, 1992 | 3 | 1992 |
PCILO: problems in predicting valid structure MC Wrinn, MA Whitehead Journal of Molecular Structure: THEOCHEM 137 (3-4), 197-205, 1986 | 3 | 1986 |
Density functional methods and applications to materials problems YS Li, MA Van Daelen, D King-Smith, M Wrinn, E Wimmer, JM Newsam, ... MRS Online Proceedings Library (OPL) 323, 233, 1993 | 2 | 1993 |
Parallel computing: thoughts following a four-year tour of academic outreach M Wrinn ACM Inroads 3 (3), 4-8, 2012 | 1 | 2012 |