Results 201 to 210 of about 59,454 (311)

Quantum Computer Simulation of Molecules in Optical Cavity. [PDF]

Precis Chem
Sheng Z, Ge Y, Chen J, Li W, Shuai Z.
europepmc   +1 more source

Intelligent pharmaceutical patent search on a near-term gate-based quantum computer. [PDF]

Sci Rep, 2022
Wang PH, Chen JH, Tseng YJ.
europepmc   +1 more source

Intrabandgap States Engineering in Functionalized Nanodiamond to Generate Solvated Electrons for Photocatalysis Under Solar Illumination

Advanced Functional Materials, EarlyView.
The negative electron affinity of diamond allows to emit highly reductive electrons. By introducing intra‐bandgap states and an optimized electron transfer mechanism by surface functionalization with Ru(bpy)3, the formation of solvated electrons is achieved upon solar irradiation.
Benjamin Kiendl, Arsène Chemin, Adam H. Day, Rocio B. Rodriguez, Sneha Choudhury, Franziska Buchner, Kaan Atak, Christoph Merschjann, Emina Hadzifejzovic, Tim D. W. Claridge, Karin Larsson, Amélie Venerosy, Mailis M. Lounasvuori, Natalia Zabarska, Boyan Iliev, Thomas J. S. Schubert, Hugues A. Girard, Jean‐Charles Arnault, John S. Foord, Tristan Petit, Anke Krueger   +20 more
wiley   +1 more source

Measuring correlation and entanglement between molecular orbitals on a trapped-ion quantum computer. [PDF]

Sci Rep
Greene-Diniz G, Self CN, Krompiec M, Coopmans L, Benedetti M, Muñoz Ramo D, Rosenkranz M.   +6 more
europepmc   +1 more source

Best-Practice Aspects of Quantum-Computer Calculations: A Case Study of the Hydrogen Molecule. [PDF]

Molecules, 2022
Miháliková I, Friák M, Pivoluska M, Plesch M, Saip M, Šob M.   +5 more
europepmc   +1 more source

Real time evolution and a traveling excitation in SU(2) pure gauge theory on a quantum computer.

, 2023
Emanuele Mendicelli, Randy Lewis, Sarmed A Rahman, Sarah Powell   +3 more
openalex   +1 more source

Chiral SURMOFs for Vibrational Circular Dichroism: Multiscale Modeling and Experimental Insights

Advanced Functional Materials, EarlyView.
The use of solid‐state vibrational circular dichroism (VCD) for MOFs is still somewhat unexplored, and in this work, it is shown that chiral surface‐anchored MOFs (SURMOFs) grown on CaF2 provide an excellent platform for VCD. Experimental results are validated through multiscale modeling, showing strong agreement across multiple spectroscopic ...
Ana C. Fingolo, Nadine von Coelln, Benedikt Zerulla, Marjan Krstić, Christian Huck, Thomas G. Mayerhöfer, Christoph Krafft, Petra Tegeder, Carsten Rockstuhl, Christof Wöll   +9 more
wiley   +1 more source

Scaling and networking a modular photonic quantum computer. [PDF]

Nature
Aghaee Rad H, Ainsworth T, Alexander RN, Altieri B, Askarani MF, Baby R, Banchi L, Baragiola BQ, Bourassa JE, Chadwick RS, Charania I, Chen H, Collins MJ, Contu P, D'Arcy N, Dauphinais G, De Prins R, Deschenes D, Di Luch I, Duque S, Edke P, Fayer SE, Ferracin S, Ferretti H, Gefaell J, Glancy S, González-Arciniegas C, Grainge T, Han Z, Hastrup J, Helt LG, Hillmann T, Hundal J, Izumi S, Jaeken T, Jonas M, Kocsis S, Krasnokutska I, Larsen MV, Laskowski P, Laudenbach F, Lavoie J, Li M, Lomonte E, Lopetegui CE, Luey B, Lund AP, Ma C, Madsen LS, Mahler DH, Mantilla Calderón L, Menotti M, Miatto FM, Morrison B, Nadkarni PJ, Nakamura T, Neuhaus L, Niu Z, Noro R, Papirov K, Pesah A, Phillips DS, Plick WN, Rogalsky T, Rortais F, Sabines-Chesterking J, Safavi-Bayat S, Sazhaev E, Seymour M, Rezaei Shad K, Silverman M, Srinivasan SA, Stephan M, Tang QY, Tasker JF, Teo YS, Then RB, Tremblay JE, Tzitrin I, Vaidya VD, Vasmer M, Vernon Z, Villalobos LFSSM, Walshe BW, Weil R, Xin X, Yan X, Yao Y, Zamani Abnili M, Zhang Y.   +89 more
europepmc   +1 more source

Author Correction: Intelligent pharmaceutical patent search on a near-term gate-based quantum computer. [PDF]

Sci Rep, 2022
Wang PH, Chen JH, Tseng YJ.
europepmc   +1 more source

Zwitterionic Self‐Assembled Monolayer for Simultaneous Noise Suppression and Hole Extraction in High‐Performance Near‐Infrared Organic Photodetectors

Advanced Functional Materials, EarlyView.
This study presents a new hole transporting material (HTM) mechanism for self‐assembled monolayers in near‐infrared organic photodetectors. The formation of zwitterions induces a strong electric field that significantly increases the work function of HTM‐coated indium tin oxide substrates. The devices exhibit low dark current and noise, along with high
Jiyoung Shin, Gyeong Min Lee, Juyeon Shin, Jaewoong Kim, Tae Hyuk Kim, Do Yeon Kim, Myeong In Kim, Kyeounghak Kim, Jae Won Shim, In Hwan Jung   +9 more
wiley   +1 more source