Analytic energy derivatives for the equation-of-motion coupled-cluster method: Algebraic expressions, implementation and application to theS 1 state of HFCO

Author:

Stanton John F.,Gauss J�rgen

Publisher

Springer Science and Business Media LLC

Subject

Chiropractics,Physical and Theoretical Chemistry

Reference80 articles.

1. See, for example, review articles by Werner H-J (p. 1); Shepard R (p. 62); Ross BO (p. 399) 1987 In: Lawley KP (ed.) Ab initio methods in quantum chemistry, Part II, Wiley, New York

2. Kim K, Shavitt I, Del Bene JE (1992) J Chem Phys 96:7573; Del Bene J, Kim K, Shavitt I (1991) Can J Chem 69:246, and references therein

3. Szalay PG, Karpfen A, Lischka H (1990) Chem Phys 141:355, and references therein

4. Pacchioni G, Koutecky J (1988) J Chem Phys 1066: and references therein

5. Bruna PJ, Peyerimhoff SD (1987) Adv Chem Phys 67:1 (1987), and references therein

同舟云学术

1.学者识别学者识别

2.学术分析学术分析

3.人才评估人才评估

"同舟云学术"是以全球学者为主线,采集、加工和组织学术论文而形成的新型学术文献查询和分析系统,可以对全球学者进行文献检索和人才价值评估。用户可以通过关注某些学科领域的顶尖人物而持续追踪该领域的学科进展和研究前沿。经过近期的数据扩容,当前同舟云学术共收录了国内外主流学术期刊6万余种,收集的期刊论文及会议论文总量共计约1.5亿篇,并以每天添加12000余篇中外论文的速度递增。我们也可以为用户提供个性化、定制化的学者数据。欢迎来电咨询!咨询电话:010-8811{复制后删除}0370

www.globalauthorid.com

TOP

Copyright © 2019-2024 北京同舟云网络信息技术有限公司
京公网安备11010802033243号  京ICP备18003416号-3