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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
Nature Chemistry, ISSN 1755-4330, 10/2012, Volume 4, Issue 10, pp. 794 - 801
The success of solar fuel technology relies on the development of efficient catalysts that can oxidize or reduce water. All molecular water-oxidation catalysts... 
DIOXYGEN | EVOLUTION | REDUCTION | MECHANISM | DIMER | COMPLEXES | PHOTOSYSTEM-II | O BOND FORMATION | IDENTIFICATION | OXYGEN-EVOLVING CATALYST | CHEMISTRY, MULTIDISCIPLINARY | Electrodes | Electrochemical Techniques | Oxidation-Reduction | Oxygen - chemistry | Water - chemistry | Flavins - chemistry | Catalysis | Platinum - chemistry | Carbon - chemistry
Journal Article
Journal of Chemical Theory and Computation, ISSN 1549-9618, 02/2015, Volume 11, Issue 2, pp. 518 - 527
An efficient new molecular orbital (MO) basis algorithm is reported implementing the pair atomic resolution of the identity approximation (PARI) to evaluate... 
INTEGRALS | AUXILIARY BASIS-SETS | CONSISTENT BASIS-SETS | THERMOCHEMISTRY | TRANSFER EXCITED-STATES | SCF | ALGORITHM | PHYSICS, ATOMIC, MOLECULAR & CHEMICAL | CHEMISTRY, PHYSICAL | GAUSSIAN-3 | HARTREE-FOCK | GRADIENT | Quantum Theory | Algorithms
Journal Article
Chemical Physics Letters, ISSN 0009-2614, 2010, Volume 485, Issue 1, pp. 258 - 261
Configuration state function (CSF) orbitals that allow for spin –orbit coupling responsible for singlet–triplet intersystem crossing. A dichloro derivative of... 
CHEMISTRY, PHYSICAL | NAPHTHALENE | TRIPLET-STATE | DERIVATIVES | PHYSICS, ATOMIC, MOLECULAR & CHEMICAL
Journal Article
01/2016, ISBN 1369055439
This thesis describes several new theoretical developments that facilitate the computation of the exact exchange energy, a vital component of accurate... 
Quantum physics
Dissertation
1994, ISBN 0802006043, xii, 350
This book interprets the framework of political ideas and beliefs that structure individual and collective thinking about educational policies and give them... 
History | Education | Education and state | Comparative Education | Policy | International Education | Public Policy | Public Schools | Educational Policy | Foreign Countries | Governance | School Policy | Elementary Secondary Education | Foundations of Education | Canada | Educational History | Political Issues | Politics
Book
1977, Canadian experience series, ISBN 9780887781384, x, 173 p., [2] leaves of plates
Book
Wildlife Biology, ISSN 0909-6396, 2008, Volume 14, Issue 1, pp. 16 - 25
Abstract We studied survival and probable causes of mortality for plains sharp-tailed grouse Tympanuchus phasianellus jamesi chicks up to 30 days of age, and... 
hen | survival | mortality | Kaplan-Meier | predation | sharp-tailed grouse | landscape | chick | HEN | MORTALITY | SURVIVAL | PREDATION | SHARP-TAILED GROUSE | LANDSCAPE | KAPLAN-MEIER | CHICK | Hen | Sharp-tailed grouse | Landscape | Mortality | Predation | Chick | Survival | CORVID DENSITY | POPULATION | RUFFED GROUSE | BREEDING SUCCESS | ZOOLOGY | BLACK GROUSE | NEST SUCCESS | ECOLOGY | LAGOPUS-LAGOPUS | DUCKLINGS | TETRAO-TETRIX
Journal Article
01/1962, ISBN 108472149X
Dissertation
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