검색결과 : 3건
No. | Article |
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1 |
Performance of Property-Optimized Basis Sets for Optical Rotation with Coupled Cluster Theory Howard JC, Sowndarya SVS, Ansari IM, Mach TJ, Baranowska-Laczkowska A, Crawford TD Journal of Physical Chemistry A, 122(28), 5962, 2018 |
2 |
Basis Set Dependence of Coupled Cluster Optical Rotation Computations Mach TJ, Crawford TD Journal of Physical Chemistry A, 115(35), 10045, 2011 |
3 |
A Coupled Cluster Benchmark Study of the Electronic Spectrum of the Allyl Radical Mach TJ, King RA, Crawford TD Journal of Physical Chemistry A, 114(33), 8852, 2010 |