Showing results (71-80 of 135) with videos related to
Sort By:
Pageof 14
The Journal of Chemical Physics|October 2, 2007
Behavior of density functionals with respect to basis set. VI. Truncation of the correlation consistent basis setsBrian P Prascher, Brent R Wilson, Angela K WilsonChemphyschem : a European Journal of Chemical Physics and Physical Chemistry|May 23, 2014
High-potential perfluorinated phthalocyanine-fullerene dyads for generation of high-energy charge-separated states: formation and photoinduced electron-transfer studiesSushanta K Das, Andrew Mahler, Angela K Wilson, et al.Journal of Chemical Theory and Computation|November 26, 2015
Comparative Study of Single and Double Hybrid Density Functionals for the Prediction of 3d Transition Metal ThermochemistryWanyi Jiang, Marie L Laury, Mitchell Powell, et al.The Journal of Physical Chemistry. A|July 4, 2019
Theoretical Studies of Two Key Low-Lying Carbenes of C5H2 Missing in the LaboratoryVenkatesan S Thimmakondu, Inga Ulusoy, Angela K Wilson, et al.The Journal of Physical Chemistry. A|May 14, 2010
Theoretical studies on the catalysis of the reverse water-gas shift reaction using first-row transition metal beta-diketiminato complexesCong Liu, Lloyd Munjanja, Thomas R Cundari, et al.ACS Omega|August 29, 2019
Toward a More Rational Design of the Direct Synthesis of Aniline: A Density Functional Theory StudyZainab H A Alsunaidi, Thomas R Cundari, Angela K WilsonThe Journal of Chemical Physics|June 25, 2009
Computation of potential energy surfaces with the multireference correlation consistent composite approachBenjamin Mintz, T Gavin Williams, Levi Howard, et al.The Journal of Chemical Physics|March 22, 2013
Spectroscopic properties of Ar(x)-Zn and Ar(x)-Ag(+) (x = 1,2) van der Waals complexesGbenga A Oyedepo, Charles Peterson, George Schoendorff, et al.International Journal of Surgery (London, England)|November 5, 2019
Communication and management of incidental pathology in 1,214 consecutive appendicectomies; a cohort studyNed Kinnear, Bridget Heijkoop, Eliza Bramwell, et al.Frontiers in Chemistry|May 8, 2023
Population analysis and the effects of Gaussian basis set quality and quantum mechanical approach: main group through heavy element speciesSasha C North, Kameron R Jorgensen, Jason Pricetolstoy, et al.Pageof 14