Symmetry in Quantum and Computational Chemistry: Volume 2

被引：1
作者：
Novikov, Alexander S. [1 ,2 ,3 ,4 ]
机构：
[1] St Petersburg State Univ, Inst Chem, Univ skaya Emb 7-9, St Petersburg 199034, Russia
[2] ITMO Univ, Infochem Sci Ctr, Kronverksky Pr 49, bldg A, St Petersburg 197101, Russia
[3] RUDN Univ, Peoples Friendship Univ Russia, Res Inst Chem, Miklukho Maklaya St 6, Moscow 117198, Russia
[4] Bauman Moscow State Tech Univ, Ctr NTI Digital Mat Sci New Mat & Subst, Sci & Educ Ctr Composites Russia, 2nd Baumanskaya St, 5-1, Moscow 105005, Russia
来源：
SYMMETRY-BASEL | 2023年 / 15卷 / 08期
关键词：
D O I：
10.3390/sym15081472
中图分类号：
O [数理科学和化学]; P [天文学、地球科学]; Q [生物科学]; N [自然科学总论];
学科分类号：
07 ; 0710 ; 09 ;
摘要：
引用
收藏
页数：2
相关论文
共 50 条
[31]   Symmetrizing broken symmetry wave functions in quantum chemistry [J].
Cassam-Chenai, P .
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 1998, 68 (02) :91-101
[32]   Quantum chemical exercise linking computational chemistry to general chemistry topics [J].
Simpson, Scott ;
Evanoski-Cole, Ashley ;
Gast, Kellie ;
Wedvik, Madeleine C. ;
Schneider, Patrick W. ;
Klingensmith, Isaac .
CHEMISTRY TEACHER INTERNATIONAL, 2021, 3 (01)
[33]   On the hydration activity of Ca2Fe2-xAlxO5 with computational quantum chemistry [J].
Cheng, Xin ;
Feng, Xiuji ;
Tong, Damao .
Cailiao Yanjiu Xuebao/Chinese Journal of Materials Research, 1996, 10 (03) :293-296
[34]   Enhancing computational peptide therapeutic design with quantum chemistry and quantum computing [J].
Mulligan, Vikram ;
Zaborniak, Tristan ;
Renfrew, P. Douglas ;
Brown, Benjamin .
JOURNAL OF PEPTIDE SCIENCE, 2024, 30
[35]   Linear-Scaling Quantum Circuits for Computational Chemistry [J].
Magoulas, Ilias ;
Evangelista, Francesco A. .
JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 2023, 19 (15) :4815-4821
[36]   Computational chemistry on quantum computers: Ground state estimation [J].
Armaos, V ;
Badounas, Dimitrios A. ;
Deligiannis, Paraskevas ;
Lianos, Konstantinos .
APPLIED PHYSICS A-MATERIALS SCIENCE & PROCESSING, 2020, 126 (08)
[37]   COMPUTATIONAL CHEMISTRY Largest molecular quantum computation performed [J].
Lemonick, Sam .
CHEMICAL & ENGINEERING NEWS, 2020, 98 (33) :8-8
[38]   Numerical Simulations of Noisy Quantum Circuits for Computational Chemistry [J].
Gowrishankar, Meenambika ;
Wright, Jerimiah ;
Claudino, Daniel ;
Lotshaw, Phillip ;
Thien Nguyen ;
McCaskey, Alex ;
Humble, Travis .
2022 IEEE INTERNATIONAL CONFERENCE ON QUANTUM COMPUTING AND ENGINEERING (QCE 2022), 2022, :813-815
[39]   Computational quantum chemistry: Applications from the atomic to the nanoscale [J].
Maroulis, George .
RECENT PROGRESS IN COMPUTATIONAL SCIENCES AND ENGINEERING, VOLS 7A AND 7B, 2006, 7A-B :1445-1446
[40]   Computational quantum chemistry studies of metal oxide clusters [J].
Partovi, Sheyda ;
Thompson, Lee ;
Hratchian, Hrant .
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2017, 253
12345