Zobrazeno 1 - 10
of 2 655
pro vyhledávání: '"Irle, A."'
We introduce QuantumGEP, a scientific computer program that uses gene expression programming (GEP) to find a quantum circuit that either (i) maps a given set of input states to a given set of output states, or (ii) transforms a fixed initial state to
Externí odkaz:
http://arxiv.org/abs/2303.08203
Autor:
Jung, Gang Seob, Yoo, Pilsun, Ryder, Matthew R., Vautard, Frederic, Annamraju, Aparna, Irle, Stephan, Gallego, Nidia C., Lara-Curzio, Edgar
Publikováno v:
In Carbon November 2024 230
Flexible forward improvement iteration for infinite time horizon Markovian optimal stopping problems
In this paper, we propose an extension of the forward improvement iteration algorithm, originally introduced in Irle (2006) and recently reconsidered in Miclo and Villeneuve (2021). The main new ingredient is a flexible window parameter describing th
Externí odkaz:
http://arxiv.org/abs/2111.13443
Autor:
Yuan, Ke, Rampal, Nikhil, Irle, Stephan, Criscenti, Louise J., Lee, Sang Soo, Adapa, Sai, Stack, Andrew G.
Publikováno v:
In Journal of Colloid And Interface Science 15 July 2024 666:232-243
Autor:
Pilsun Yoo, Debsindhu Bhowmik, Kshitij Mehta, Pei Zhang, Frank Liu, Massimiliano Lupo Pasini, Stephan Irle
Publikováno v:
Scientific Reports, Vol 13, Iss 1, Pp 1-13 (2023)
Abstract The inverse design of novel molecules with a desirable optoelectronic property requires consideration of the vast chemical spaces associated with varying chemical composition and molecular size. First principles-based property predictions ha
Externí odkaz:
https://doaj.org/article/5f550d65da794ec3af0deb3800f0d776
Publikováno v:
In Patterns 12 April 2024 5(4)
Autor:
Yoo, Pilsun, Jung, Gang Seob, Ryder, Matthew R., Vautard, Frederic, Cakmak, Ercan, Wi, Sungsool, Weisenberger, Matthew C., Lara-Curzio, Edgar, Mathews, Jonathan P., Irle, Stephan
Publikováno v:
In Carbon 25 March 2024 222
Autor:
Bajaj, Mayur, Asokan, Vishwadeep, Mishra, Priti, Reddy, Suma Krishna, Irle, Hemant, Rajbangshi, Nizu, Firdose, Seema, Vaishnavi, Sindhuja, Banerjee, Pradipta
Publikováno v:
In Materials Chemistry and Physics 1 March 2024 315
Autor:
Annamraju, Aparna, Jung, Gang Seob, Bhagia, Samarthya, Damron, Joshua T., Ryder, Matthew R., Arnould, Mark A., Cakmak, Ercan, Vautard, Frederic, Paul, Ryan M., Irle, Stephan, Gallego, Nidia C., Curzio, Edgar Lara
Publikováno v:
In Fuel 1 February 2024 357 Part C
Publikováno v:
Scientific Data, Vol 10, Iss 1, Pp 1-14 (2023)
Abstract We present two open-source datasets that provide time-dependent density-functional tight-binding (TD-DFTB) electronic excitation spectra of organic molecules. These datasets represent predictions of UV-vis absorption spectra performed on opt
Externí odkaz:
https://doaj.org/article/7be8c6b6dc734fff8d58e851274d4cae