Zobrazeno 1 - 10
of 251
pro vyhledávání: '"Debashis Mukherjee"'
Publikováno v:
International Journal of Molecular Sciences, Vol 3, Iss 6, Pp 733-754 (2002)
Abstract: We present in this paper two new versions of Rayleigh-Schr¨odinger (RS) and the Brillouin-Wigner (BW) state-specific multi-reference perturbative theories (SSMRPT) which stem from our state-specific multi-reference coupled-cluster f
Externí odkaz:
https://doaj.org/article/0a11890dc9c04503b38033ed4ba71d90
Publikováno v:
International Journal of Molecular Sciences, Vol 3, Iss 5, Pp 550-569 (2002)
Abstract: We have presented in this paper a new cluster Ansatz for the wave operator for open-shell and/or quasidegenerate states, which takes care of strong relaxation and correlation effects in a compact and efficient manner. This Ansatz allows con
Externí odkaz:
https://doaj.org/article/e7fa0388e2bd4bd4b8ea8409a8ec3ff7
Publikováno v:
The North American Journal of Economics and Finance. 64:101861
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::1c8e6fa15bd071040fbc132c69ef40ca
https://doi.org/10.1016/j.najef.2022.101861
https://doi.org/10.1016/j.najef.2022.101861
Publikováno v:
Molecular Physics. 119
The Unitary Group Adapted Open Shell Coupled Cluster (UGA-OSCC) theory, which is the single reference CSF limit of the UGA-State Universal Multireference CC (UGA-SUMRCC) formulation by Mukherjee et...
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::df455892844901c1d5f037435fe4199f
https://doi.org/10.1080/00268976.2021.1979676
https://doi.org/10.1080/00268976.2021.1979676
Autor:
Debashis Mukherjee, Rajib Mall
Publikováno v:
International Journal of System Assurance Engineering and Management. 10:576-601
A large number of test coverage metrics have been proposed in the context of unit and system testing of object-oriented programs. However, structural coverage metrics for integration testing have scarcely been reported. On the other hand, interface b
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::493f62887467a3f896b72ceef29420eb
https://doi.org/10.1007/s13198-019-00787-9
https://doi.org/10.1007/s13198-019-00787-9
The Unitary Group Adapted State-Specific Multi-Reference Perturbation Theory (UGA-SSMRPT2) developed by Mukherjee et al [J. Comput. Chem. 2015, 36, 670] has successfully realized the goal of studying bond dissociation in a numerically stable, spin-pr
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::a90557a3418daf7f2c5927d4174deb4f
http://arxiv.org/abs/2010.11471
http://arxiv.org/abs/2010.11471
Publikováno v:
ACM SIGSOFT Software Engineering Notes. 43:1-4
Though a large number of test coverage metrics have been proposed in the context of unit and system testing of object oriented programs, structural coverage metrics for integration testing have scarcely been reported. In this context, we propose an i
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::54a78c71fc47c9d5888d67ded7188062
https://doi.org/10.1145/3178315.3178330
https://doi.org/10.1145/3178315.3178330
Autor:
Debashis Mukherjee
Publikováno v:
TENCON
Software is a crucial component of many safety-critical applications, such as nuclear power plant, fly-by-wire application, medical instruments, space applications etc. They need to satisfy safety standards such as safety integrity level (SIL), IEEE
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::784b8c431e9db452106e62f2d1153b7f
https://doi.org/10.1109/tencon.2019.8929387
https://doi.org/10.1109/tencon.2019.8929387
Publikováno v:
SSRN Electronic Journal.
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::c5113678888809b34c98d58cb1d8170c
https://doi.org/10.2139/ssrn.3432808
https://doi.org/10.2139/ssrn.3432808
Publikováno v:
Journal of Chemical Theory and Computation. 11:4129-4145
Profiling a potential energy surface (PES), all the way to dissociate a molecular state into particular fragments and to display real or avoided crossings, requires a multireference description and the maintenance of size-consistency. The many body m
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::f063fcb66ac635249ccfff60441b423c
https://doi.org/10.1021/acs.jctc.5b00457
https://doi.org/10.1021/acs.jctc.5b00457