| NWCHEM, A Computational Chemistry Package for Parallel Computers, Version 5.1 (2007) EJ Bylaska, WA de Jong, K Kowalski, TP Straatsma, M Valiev, D Wang, ... Pacific Northwest National Laboratory, Richland, Washington 99352, 2005 | 594* | 2005 |
| NWChem, A computational chemistry package for parallel computers, version 5.1 EJ Bylaska, WA De Jong, N Govind, K Kowalski, TP Straatsma, M Valiev, ... Pacific Northwest National Laboratory, Richland, Washington 99352, 0999, 2007 | 564 | 2007 |
| NWChem, a computational chemistry package for parallel computers, Version 5.1 EJ Bylaska, WA De Jong, N Govind, K Kowalski, TP Straatsma, M Valiev, ... Pacific Northwest National Laboratory, Richland, Washington 99352, 0999, 2007 | 564 | 2007 |
| NWChem: Past, present, and future E Apra, EJ Bylaska, WA De Jong, N Govind, K Kowalski, TP Straatsma, ... The Journal of chemical physics 152 (18), 184102, 2020 | 528 | 2020 |
| NWChem: Past, present, and future E Aprà, EJ Bylaska, WA de Jong, N Govind, K Kowalski, TP Straatsma, ... The Journal of Chemical Physics 152 (18), 184102, 2020 | 528 | 2020 |
| High-level multireference methods in the quantum-chemistry program system COLUMBUS: Analytic MR-CISD and MR-AQCC gradients and MR-AQCC-LRT for excited states, GUGA spin–orbit … H Lischka, R Shepard, RM Pitzer, I Shavitt, M Dallos, T Müller, PG Szalay, ... Physical Chemistry Chemical Physics 3 (5), 664-673, 2001 | 481 | 2001 |
| Singlet fission in pentacene through multi-exciton quantum states PM Zimmerman, Z Zhang, CB Musgrave Nature Chemistry 2 (8), 648-652, 2010 | 441 | 2010 |
| Hydrogenation of single-walled carbon nanotubes A Nikitin, H Ogasawara, D Mann, R Denecke, Z Zhang, H Dai, K Cho, ... Physical review letters 95 (22), 225507, 2005 | 352 | 2005 |
| Hydrogen storage in carbon nanotubes through the formation of stable CH bonds A Nikitin, X Li, Z Zhang, H Ogasawara, H Dai, A Nilsson Nano letters 8 (1), 162-167, 2008 | 254 | 2008 |
| NWCHEM, a computational chemistry package for parallel computers, Version 4.6 TP Straatsma, E Apra, TL Windus, EJ Bylaska, W de Jong, S Hirata, ... Pacific Northwest National Laboratory, Richland, Washington, 99352-0999, 2004 | 239 | 2004 |
| NWCHEM, a computational chemistry package for parallel computers, Version 4.6 TP Straatsma, E Apra, TL Windus, EJ Bylaska, W de Jong, S Hirata, ... Pacific Northwest National Laboratory, Richland, Washington, 99352-0999, 2004 | 239 | 2004 |
| Spin-orbit configuration interaction using the graphical unitary group approach and relativistic core potential and spin-orbit operators S Yabushita, Z Zhang, RM Pitzer The Journal of Physical Chemistry A 103 (29), 5791-5800, 1999 | 205 | 1999 |
| NWChem E Apra, EJ Bylaska, WA de Jong, N Govind, K Kowalski, TP Straatsma, ... American Institute of Physics, 2020 | 187 | 2020 |
| Sequestering uranium from seawater: binding strength and modes of uranyl complexes with glutarimidedioxime G Tian, SJ Teat, Z Zhang, L Rao Dalton Transactions 41 (38), 11579-11586, 2012 | 185 | 2012 |
| The Role of Free N‐Heterocyclic Carbene (NHC) in the Catalytic Dehydrogenation of Ammonia–Borane in the Nickel NHC System PM Zimmerman, A Paul, Z Zhang, CB Musgrave Angewandte Chemie International Edition 48 (12), 2201-2205, 2009 | 131 | 2009 |
| Electronic Structure and Spectra of Actinyl Ions S Matsika, Z Zhang, SR Brozell, JP Blaudeau, Q Wang, RM Pitzer The Journal of Physical Chemistry A 105 (15), 3825-3828, 2001 | 127 | 2001 |
| C–H bond formation at the graphite surface studied with core level spectroscopy A Nikitin, LÅ Näslund, Z Zhang, A Nilsson Surface Science 602 (14), 2575-2580, 2008 | 118 | 2008 |
| Application of relativistic quantum chemistry to the electronic energy levels of the uranyl ion Z Zhang, RM Pitzer The Journal of Physical Chemistry A 103 (34), 6880-6886, 1999 | 113 | 1999 |
| Application of relativistic quantum chemistry to the electronic energy levels of the uranyl ion Z Zhang, RM Pitzer The Journal of Physical Chemistry A 103 (34), 6880-6886, 1999 | 113 | 1999 |
| Oligomerization and Autocatalysis of NH2BH2 with Ammonia− Borane PM Zimmerman, A Paul, Z Zhang, CB Musgrave Inorganic chemistry 48 (3), 1069-1081, 2009 | 108 | 2009 |
Charles MusgraveRobert H. Davis Professor of Chemical and Biological Engineering, University of Colorado BoulderEmail verificata su colorado.edu
