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by Shao, Yihan and Gan, Zhengting and Epifanovsky, Evgeny and Gilbert, Andrew T.B and Wormit, Michael and Kussmann, Joerg and Lange, Adrian W and Behn, Andrew and Deng, Jia and Feng, Xintian and Ghosh, Debashree and Goldey, Matthew and Horn, Paul R and Jacobson, Leif D and Kaliman, Ilya and Khaliullin, Rustam Z and Kuś, Tomasz and Landau, Arie and Liu, Jie and Proynov, Emil I and Rhee, Young Min and Richard, Ryan M and Rohrdanz, Mary A and Steele, Ryan P and Sundstrom, Eric J and Woodcock, H. Lee and Zimmerman, Paul M and Zuev, Dmitry and Albrecht, Ben and Alguire, Ethan and Austin, Brian and Beran, Gregory J. O and Bernard, Yves A and Berquist, Eric and Brandhorst, Kai and Bravaya, Ksenia B and Brown, Shawn T and Casanova, David and Chang, Chun-Min and Chen, Yunqing and Chien, Siu Hung and Closser, Kristina D and Crittenden, Deborah L and Diedenhofen, Michael and DiStasio, Robert A and Do, Hainam and Dutoi, Anthony D and Edgar, Richard G and Fatehi, Shervin and Fusti-Molnar, Laszlo and Ghysels, An and Golubeva-Zadorozhnaya, Anna and Gomes, Joseph and Hanson-Heine, Magnus W.D and Harbach, Philipp H.P and Hauser, Andreas W and Hohenstein, Edward G and Holden, Zachary C and Jagau, Thomas-C and Ji, Hyunjun and Kaduk, Benjamin and Khistyaev, Kirill and Kim, Jaehoon and Kim, Jihan and King, Rollin A and Klunzinger, Phil and Kosenkov, Dmytro and Kowalczyk, Tim and Krauter, Caroline M and Lao, Ka Un and Laurent, Adèle D and Lawler, Keith V and Levchenko, Sergey V and Lin, Ching Yeh and Liu, Fenglai and Livshits, Ester and Lochan, Rohini C and Luenser, Arne and Manohar, Prashant and Manzer, Samuel F and Mao, Shan-Ping and Mardirossian, Narbe and Marenich, Aleksandr V and Maurer, Simon A and Mayhall, Nicholas J and Neuscamman, Eric and Oana, C. Melania and Olivares-Amaya, Roberto and O'Neill, Darragh P and Parkhill, John A and Perrine, Trilisa M and Peverati, Roberto and Prociuk, Alexander and Rehn, Dirk R and Rosta, Edina and Russ, Nicholas J and Sharada, Shaama M and Sharma, Sandeep and Small, David W and Sodt, Alexander and ...
Molecular Physics, ISSN 0026-8976, 01/2015, Volume 113, Issue 2, pp. 184 - 215
Journal Article
Physical Chemistry Chemical Physics, ISSN 1463-9076, 2006, Volume 8, Issue 27, pp. 3172 - 3191
Advances in theory and algorithms for electronic structure calculations must be incorporated into program packages to enable them to become routinely used by... 
PLESSET PERTURBATION-THEORY | NMR CHEMICAL-SHIFTS | POTENTIAL-ENERGY SURFACES | PHYSICS, ATOMIC, MOLECULAR & CHEMICAL | AB-INITIO CALCULATIONS | CHEMISTRY, PHYSICAL | FAST MULTIPOLE METHOD | DUAL BASIS-SETS | DENSITY-FUNCTIONAL THEORY | COUPLED-CLUSTER DOUBLES | ELECTRONIC-STRUCTURE CALCULATIONS | GAUSSIAN-BASIS SETS
Journal Article
Physical chemistry chemical physics : PCCP, ISSN 1463-9076, 07/2006, Volume 8, Issue 27, pp. 3172 - 3191
Advances in theory and algorithms for electronic structure calculations must be incorporated into program packages to enable them to become routinely used by... 
Thermodynamics | Quantum Theory | Algorithms | Magnetic Resonance Spectroscopy | Models, Chemical | Biophysics - methods | Cluster Analysis | Electrons
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Journal of Chemical Theory and Computation, ISSN 1549-9618, 05/2017, Volume 13, Issue 5, p. 1980
The exact exchange energy and its energy density are useful but computationally expensive ingredients in density functional approximations for Kohn–Sham... 
Exchanging | Particle density (concentration) | Flux density | Upper bounds | Density functional theory | Mathematical models
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Theoretical Chemistry Accounts, ISSN 1432-881X, 11/2016, Volume 135, Issue 11, pp. 1 - 11
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International Journal of Quantum Chemistry, ISSN 0020-7608, 02/2006, Volume 106, Issue 2, pp. 436 - 446
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Physical Review A, ISSN 1050-2947, 10/2013, Volume 88, Issue 4
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International Journal of Quantum Chemistry, ISSN 0020-7608, 2008, Volume 108, Issue 5, pp. 827 - 836
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Physical Review A - Atomic, Molecular, and Optical Physics, ISSN 1050-2947, 10/2013, Volume 88, Issue 4
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Journal of Chemical Theory and Computation, ISSN 1549-9618, 04/2012, Volume 8, Issue 4, p. 1514
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Journal of Chemical Theory and Computation, ISSN 1549-9618, 04/2012, Volume 8, Issue 4, pp. 1514 - 1514
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Journal of Mathematical Chemistry, ISSN 0259-9791, 7/2008, Volume 44, Issue 1, pp. 260 - 269
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International Journal of Quantum Chemistry, ISSN 0020-7608, 2006, Volume 106, Issue 2, pp. 436 - 446
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