Devin Matthews
Devin Matthews
Email verificata su smu.edu
Titolo
Citata da
Citata da
Anno
Ab initio determination of the crystalline benzene lattice energy to sub-kilojoule/mole accuracy
J Yang, W Hu, D Usvyat, D Matthews, M Schütz, GKL Chan
Science 345 (6197), 640-643, 2014
2112014
Calculation of vibrational transition frequencies and intensities in water dimer: comparison of different vibrational approaches
HG Kjaergaard, AL Garden, GM Chaban, RB Gerber, DA Matthews, ...
The Journal of Physical Chemistry A 112 (18), 4324-4335, 2008
1772008
A massively parallel tensor contraction framework for coupled-cluster computations
E Solomonik, D Matthews, JR Hammond, JF Stanton, J Demmel
Journal of Parallel and Distributed Computing 74 (12), 3176-3190, 2014
1432014
Cyclops tensor framework: Reducing communication and eliminating load imbalance in massively parallel contractions
E Solomonik, D Matthews, J Hammond, J Demmel
2013 IEEE 27th International Symposium on Parallel and Distributed …, 2013
1072013
Spectral functions of the uniform electron gas via coupled-cluster theory and comparison to the and related approximations
J McClain, J Lischner, T Watson, DA Matthews, E Ronca, SG Louie, ...
Physical Review B 93 (23), 235139, 2016
702016
Stabilization of the Simplest Criegee Intermediate from the Reaction between Ozone and Ethylene: A High-Level Quantum Chemical and Kinetic Analysis of Ozonolysis
TL Nguyen, H Lee, DA Matthews, MC McCarthy, JF Stanton
The Journal of Physical Chemistry A 119 (22), 5524-5533, 2015
602015
Calculated stretching overtone levels and Darling–Dennison resonances in water: a triumph of simple theoretical approaches
DA Matthews, J Vázquez, JF Stanton
Molecular Physics 105 (19-22), 2659-2666, 2007
602007
Coupled-cluster techniques for computational chemistry: The CFOUR program package
DA Matthews, L Cheng, ME Harding, F Lipparini, S Stopkowicz, TC Jagau, ...
The Journal of Chemical Physics 152 (21), 214108, 2020
552020
Non-orthogonal spin-adaptation of coupled cluster methods: A new implementation of methods including quadruple excitations
DA Matthews, JF Stanton
The Journal of chemical physics 142 (6), 064108, 2015
532015
A new approach to approximate equation-of-motion coupled cluster with triple excitations
DA Matthews, JF Stanton
The Journal of Chemical Physics 145 (12), 124102, 2016
452016
High-Performance Tensor Contraction without Transposition
DA Matthews
SIAM Journal on Scientific Computing 40 (1), C1-C24, 2018
442018
Quantitative analysis of Fermi resonances by harmonic derivatives of perturbation theory corrections
DA Matthews, JF Stanton
Molecular Physics 107 (3), 213-222, 2009
432009
Benchmark Calculations of K-Edge Ionization Energies for First-Row Elements Using Scalar-Relativistic Core–Valence-Separated Equation-of-Motion Coupled-Cluster Methods
J Liu, D Matthews, S Coriani, L Cheng
Journal of chemical theory and computation 15 (3), 1642-1651, 2019
302019
Generating families of practical fast matrix multiplication algorithms
J Huang, L Rice, DA Matthews, RA van de Geijn
2017 IEEE International Parallel and Distributed Processing Symposium (IPDPS …, 2017
292017
Geometric Energy Derivatives at the Complete Basis Set Limit: Application to the Equilibrium Structure and Molecular Force Field of Formaldehyde
WJ Morgan, DA Matthews, M Ringholm, J Agarwal, JZ Gong, K Ruud, ...
Journal of chemical theory and computation 14 (3), 1333-1350, 2018
222018
Accelerating the convergence of higher-order coupled cluster methods
DA Matthews, JF Stanton
The Journal of chemical physics 143 (20), 204103, 2015
202015
Communication: An accurate calculation of the S1 C2H2cis-trans isomerization barrier height
JH Baraban, DA Matthews, JF Stanton
The Journal of chemical physics 144 (11), 111102, 2016
182016
Accuracy of coupled cluster excited state potential energy surfaces
A Tajti, JF Stanton, DA Matthews, PG Szalay
Journal of chemical theory and computation 14 (11), 5859-5869, 2018
172018
Assessment of the accuracy of coupled cluster perturbation theory for open-shell systems. II. Quadruples expansions
JJ Eriksen, DA Matthews, P Jřrgensen, J Gauss
The Journal of chemical physics 144 (19), 194103, 2016
17*2016
Assessment of the accuracy of coupled cluster perturbation theory for open-shell systems. I. Triples expansions
JJ Eriksen, DA Matthews, P Jřrgensen, J Gauss
The Journal of chemical physics 144 (19), 194102, 2016
172016
Il sistema al momento non puň eseguire l'operazione. Riprova piů tardi.
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