Analytical energy gradients and geometry optimization in the divide-and-conquer method for large molecules
Publication
, Journal Article
Zhao, Q; Yang, W
Published in: J. Chem. Phys.
1995
Duke Scholars
Published In
J. Chem. Phys.
Publication Date
1995
Volume
102
Start / End Page
9598 / 9603
Related Subject Headings
- Chemical Physics
- 51 Physical sciences
- 40 Engineering
- 34 Chemical sciences
- 09 Engineering
- 03 Chemical Sciences
- 02 Physical Sciences
Citation
APA
Chicago
ICMJE
MLA
NLM
Zhao, Q., & Yang, W. (1995). Analytical energy gradients and geometry optimization in the divide-and-conquer method for large molecules. J. Chem. Phys., 102, 9598–9603.
Zhao, Qingsheng, and Weitao Yang. “Analytical energy gradients and geometry optimization in the divide-and-conquer method for large molecules.” J. Chem. Phys. 102 (1995): 9598–9603.
Zhao Q, Yang W. Analytical energy gradients and geometry optimization in the divide-and-conquer method for large molecules. J Chem Phys. 1995;102:9598–603.
Zhao, Qingsheng, and Weitao Yang. “Analytical energy gradients and geometry optimization in the divide-and-conquer method for large molecules.” J. Chem. Phys., vol. 102, 1995, pp. 9598–603.
Zhao Q, Yang W. Analytical energy gradients and geometry optimization in the divide-and-conquer method for large molecules. J Chem Phys. 1995;102:9598–9603.
Published In
J. Chem. Phys.
Publication Date
1995
Volume
102
Start / End Page
9598 / 9603
Related Subject Headings
- Chemical Physics
- 51 Physical sciences
- 40 Engineering
- 34 Chemical sciences
- 09 Engineering
- 03 Chemical Sciences
- 02 Physical Sciences