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Kshitijkumar Surjuse
Kshitijkumar Surjuse
在 vt.edu 的电子邮件经过验证
标题
引用次数
引用次数
年份
A reduced cost four-component relativistic coupled cluster method based on natural spinors
S Chamoli, K Surjuse, B Jangid, MK Nayak, AK Dutta
The Journal of Chemical Physics 156 (20), 2022
102022
A low-cost four-component relativistic equation of motion coupled cluster method based on frozen natural spinors: Theory, implementation, and benchmark
K Surjuse, S Chamoli, MK Nayak, AK Dutta
The Journal of Chemical Physics 157 (20), 2022
82022
BAGH: A quantum chemistry software package
AK Dutta, A Manna, B Jangid, K Majee, K Surjuse, M Mukherjee, M Thapa, ...
62023
Economical quasi-Newton unitary optimization of electronic orbitals
SA Slattery, KA Surjuse, CC Peterson, DA Penchoff, EF Valeev
Physical Chemistry Chemical Physics 26 (8), 6557-6573, 2024
42024
Economical Quasi-Newton Self Consistent Field Solver
SA Slattery, K Surjuse, EF Valeev
arXiv preprint arXiv:2307.00560, 2023
12023
Relativistic coupled cluster with completely renormalized and perturbative triples corrections
SH Yuwono, RR Li, T Zhang, KA Surjuse, EF Valeev, X Li, ...
The Journal of Physical Chemistry A 128 (31), 6521-6539, 2024
2024
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