Zobrazeno 1 - 10
of 137
pro vyhledávání: '"Verma, Prakash"'
Autor:
Evangelista, Francesco A., Li, Chenyang, Verma, Prakash, Hannon, Kevin P., Schriber, Jeffrey B., Zhang, Tianyuan, Cai, Chenxi, Wang, Shuhe, He, Nan, Stair, Nicholas H., Huang, Meng, Huang, Renke, Misiewicz, Jonathon P., Li, Shuhang, Marin, Kevin, Zhao, Zijun, Burns, Lori A.
Forte is an open-source library specialized in multireference electronic structure theories for molecular systems and the rapid prototyping of new methods. This paper gives an overview of the capabilities of Forte, its software architecture, and exam
Externí odkaz:
http://arxiv.org/abs/2405.10197
Autor:
Verma, Prakash, Rani, Ruchi, Das, Dhritiman, Rai, Kundan Kumar, Gogoi, Pujashree, Badwaik, Laxmikant S.
Publikováno v:
In Sustainable Chemistry and Pharmacy February 2024 37
Autor:
Verma, Prakash, Huntington, Lee, Coons, Marc, Kawashima, Yukio, Yamazaki, Takeshi, Zaribafiyan, Arman
The method of increments and frozen natural orbital (MI-FNO) framework is introduced to help expedite the application of noisy, intermediate-scale quantum~(NISQ) devices for quantum chemistry simulations. The MI-FNO framework provides a systematic re
Externí odkaz:
http://arxiv.org/abs/2002.07901
Autor:
Verma, Prakash L., Gejji, Shridhar P.
Publikováno v:
In Journal of Molecular Structure 5 February 2020 1201
Autor:
Verma, Prakash L., Gejji, Shridhar P.
Publikováno v:
In Journal of Molecular Liquids 1 November 2019 293
Autor:
Verma, Prakash L., Gejji, Shridhar P.
Publikováno v:
In Journal of Molecular Graphics and Modelling October 2018 85:304-315
Autor:
Verma, Prakash L., Gejji, Shridhar P.
Publikováno v:
In Journal of Molecular Liquids February 2018 251:394-406
Publikováno v:
In Chemical Physics 28 July 2017 492:35-52
Autor:
Verma, Prakash, Huntington, Lee, Coons, Marc P., Kawashima, Yukio, Yamazaki, Takeshi, Zaribafiyan, Arman
Publikováno v:
Journal of Chemical Physics; 7/21/2021, Vol. 155 Issue 3, p1-20, 20p
Publikováno v:
In Journal of Molecular Liquids December 2015 212:885-899