Works matching Physical %26 theoretical chemistry
1
- Bulgarian Journal of Science & Education Policy, 2011, v. 5, n. 1, p. 115
- Article
2
- Angewandte Chemie International Edition, 2016, v. 55, n. 18, p. 5378, doi. 10.1002/anie.201509260
- Article
3
- 2016
- Rühl, Eckart;
- Coluccia, Salvatore
- Proceeding
4
- Journal of Structural Chemistry, 2025, v. 66, n. 5, p. 1007, doi. 10.1134/S0022476625050142
- Patel, K.;
- Karmakar, S.;
- Chauhan, P.;
- Shah, S. K. H.;
- Prabhakaran, P.
- Article
5
- Scientific Reports, 2025, v. 15, n. 1, p. 1, doi. 10.1038/s41598-025-04051-y
- Recherache, Abdelbasset;
- Benghanem, Fatiha;
- Toukal, Linda;
- Bounedjar, Nourelhouda;
- Foudia, Malika;
- Abebe, Buzuayehu;
- Alam, Mir Waqas
- Article
6
- Journal of Nanoparticle Research, 2025, v. 27, n. 5, p. 1, doi. 10.1007/s11051-025-06330-1
- Rahimi, Rezvan;
- Solimannejad, Mohammad
- Article
7
- Environmental Science & Pollution Research, 2025, v. 32, n. 21, p. 12681, doi. 10.1007/s11356-025-36464-7
- Haris, Muhammad;
- Aziz, Arif;
- Sohail, Muhammad;
- Sardar, Waseem
- Article
8
- Journal of Electronic Materials, 2025, v. 54, n. 6, p. 4693, doi. 10.1007/s11664-025-11880-0
- Mekaoui, Yahya;
- Ouhrir, Jaouad;
- El idrissi, Mohammed;
- Abbassi, Abderrahman;
- Taj, Souad;
- Manaut, Bouzid
- Article
9
- Journal of Electronic Materials, 2025, v. 54, n. 1, p. 792, doi. 10.1007/s11664-024-11583-y
- Sinha, Prity;
- Verma, Rekha;
- Tiwari, Pramod Kumar
- Article
10
- Optical & Quantum Electronics, 2025, v. 57, n. 2, p. 1, doi. 10.1007/s11082-025-08036-z
- Willington, T. David;
- Sindhusha, S.;
- Girisun, T. C. Sabari
- Article
11
- Journal of Materials Science: Materials in Electronics, 2025, v. 36, n. 7, p. 1, doi. 10.1007/s10854-025-14469-9
- Jacksy, D. Beryl;
- Dhas, D. Arul;
- Joe, I. Hubert;
- Vinitha, G.
- Article
12
- Communications Chemistry, 2025, v. 8, n. 1, p. 1, doi. 10.1038/s42004-025-01543-w
- Das, Gorachand;
- Prabhudesai, Vaibhav S.;
- Sajeev, Y.
- Article
13
- Communications Chemistry, 2025, v. 8, n. 1, p. 1, doi. 10.1038/s42004-024-01403-z
- Garrow, Malcolm;
- Bertram, Lauren;
- Winter, Abi;
- Prentice, Andrew W.;
- Crane, Stuart W.;
- Lane, Paul D.;
- Greaves, Stuart J.;
- Paterson, Martin J.;
- Kirrander, Adam;
- Townsend, Dave
- Article
14
- NPJ Computational Materials, 2025, v. 11, n. 1, p. 1, doi. 10.1038/s41524-025-01629-y
- Chen, Weiqi;
- Xu, Zhiyue;
- Wang, Kang;
- Gao, Lei;
- Song, Aisheng;
- Ma, Tianbao
- Article
15
- NPJ Computational Materials, 2024, v. 10, n. 1, p. 1, doi. 10.1038/s41524-024-01469-2
- Zheng, Hui;
- Sivonxay, Eric;
- Christensen, Rasmus;
- Gallant, Max;
- Luo, Ziyao;
- McDermott, Matthew;
- Huck, Patrick;
- Smedskjær, Morten M.;
- Persson, Kristin A.
- Article
16
- NPJ Computational Materials, 2024, v. 10, n. 1, p. 1, doi. 10.1038/s41524-024-01460-x
- Di Paola, Cono;
- Plekhanov, Evgeny;
- Krompiec, Michal;
- Kumar, Chandan;
- Marsili, Emanuele;
- Du, Fengmin;
- Weber, Daniel;
- Krauser, Jasper Simon;
- Shishenina, Elvira;
- Muñoz Ramo, David
- Article
17
- NPJ Computational Materials, 2024, v. 10, n. 1, p. 1, doi. 10.1038/s41524-024-01460-x
- Di Paola, Cono;
- Plekhanov, Evgeny;
- Krompiec, Michal;
- Kumar, Chandan;
- Marsili, Emanuele;
- Du, Fengmin;
- Weber, Daniel;
- Krauser, Jasper Simon;
- Shishenina, Elvira;
- Muñoz Ramo, David
- Article
18
- Scientific Data, 2025, v. 11, n. 1, p. 1, doi. 10.1038/s41597-025-04468-0
- Harb, Hassan;
- Elliott, Sarah N.;
- Ward, Logan;
- Foster, Ian T.;
- Klippenstein, Stephen J.;
- Curtiss, Larry A.;
- Assary, Rajeev Surendran
- Article
19
- Scientific Data, 2025, v. 12, n. 1, p. 1, doi. 10.1038/s41597-024-04361-2
- Williams, Nicholas J.;
- Kabalan, Lara;
- Stojanovic, Ljiljana;
- Zólyomi, Viktor;
- Pyzer-Knapp, Edward O.
- Article
20
- Applied Physics A: Materials Science & Processing, 2025, v. 131, n. 5, p. 1, doi. 10.1007/s00339-025-08448-4
- Mohamad Daud, Nur Aisyah;
- Wong, Qin Ai;
- Ooi, Bi Sheng;
- Hassan, A.;
- Quah, Ching Kheng;
- Win, Yip-Foo;
- Patil, Parutagouda Shankaragouda
- Article
21
- Journal of Cheminformatics, 2025, v. 17, n. 1, p. 1, doi. 10.1186/s13321-025-00997-3
- Lešnik, Samo;
- Jukić, Marko;
- Bren, Urban
- Article
22
- Journal of Molecular Modeling, 2025, v. 31, n. 5, p. 1, doi. 10.1007/s00894-025-06355-2
- Ullah, Najeeb;
- Karim, Amir;
- Iqbal, Muhammad;
- Malekshah, Rahime Eshaghi;
- Ali, Saqib;
- Haribabu, Jebiti;
- Hsu, Sodio C. N.
- Article
23
- Journal of Molecular Modeling, 2025, v. 31, n. 4, p. 1, doi. 10.1007/s00894-025-06342-7
- Henkin, Guilherme Saldanha;
- Gnoatto, Simone Cristina Baggio;
- Defferrari, Diego;
- de Araújo, Bruno Bercini;
- Gonçalves, Paulo Fernando Bruno;
- Netz, Paulo Augusto
- Article
24
- Journal of Molecular Modeling, 2025, v. 31, n. 4, p. 1, doi. 10.1007/s00894-025-06344-5
- Sharma, Anjali;
- Guin, Mridula
- Article
25
- Journal of Molecular Modeling, 2025, v. 31, n. 3, p. 1, doi. 10.1007/s00894-025-06323-w
- Kurbatova, Marina S.;
- Barannikov, Vladimir P.
- Article
26
- 2025
- Rosa, Nathália M. P.;
- Borges Jr., Itamar
- Literature Review
27
- Journal of Molecular Modeling, 2025, v. 31, n. 3, p. 1, doi. 10.1007/s00894-025-06296-w
- Ahmed, Mukhtar;
- Sudhanshu;
- Malhotra, Sumit Sahil;
- Alsubaie, Abdullah Saad;
- El-Bahy, Salah M.;
- Mohapatra, Ranjan Kumar;
- Ansari, Azaj
- Article
28
- Journal of Molecular Modeling, 2025, v. 31, n. 1, p. 1, doi. 10.1007/s00894-024-06252-0
- Qadir, Karwan Wasman;
- Mohammadi, Mohsen Doust;
- Alosfur, Firas K. Mohamad;
- Abdullah, Hewa Y.
- Article
29
- Journal of Molecular Modeling, 2025, v. 31, n. 1, p. 1, doi. 10.1007/s00894-024-06256-w
- Forero-Girón, Angie Carolay;
- Toro-Labbé, Alejandro
- Article
30
- Journal of Molecular Modeling, 2025, v. 31, n. 1, p. 1, doi. 10.1007/s00894-024-06210-w
- Meruvia-Rojas, Yumeida V.;
- Molina-Montes, Esther;
- Hernández-Laguna, Alfonso;
- Sainz-Díaz, C. Ignacio
- Article
31
- Journal of Molecular Modeling, 2024, v. 30, n. 12, p. 1, doi. 10.1007/s00894-024-06212-8
- Liao, Yuanhao;
- Sun, Dongwei;
- Tang, Xiaobo;
- Han, Sheng;
- Dong, Xingzong;
- Zhao, Bo;
- An, Yu;
- Yang, Zhiqiang;
- Tang, Nian;
- Zeng, Jijun;
- Zhang, Wei
- Article
32
- Journal of Molecular Modeling, 2024, v. 30, n. 12, p. 1, doi. 10.1007/s00894-024-06215-5
- Costa, Caio Vinícius Sousa;
- de Souza Barbosa, Leonardo;
- Gargano, Ricardo;
- Azevedo, David Lima
- Article
33
- Journal of Molecular Modeling, 2024, v. 30, n. 12, p. 1, doi. 10.1007/s00894-024-06202-w
- Samai, Salima;
- Direm, Amani;
- Parlak, Cemal
- Article
34
- Journal of Molecular Modeling, 2024, v. 30, n. 12, p. 1, doi. 10.1007/s00894-024-06195-6
- Pérez-Tovar, Carlos A.;
- Hernández-Bravo, Raiza;
- Parra, José G.;
- Camacho, Nayeli;
- Castillo, Jimmy;
- Mujica, Vladimiro
- Article
35
- Environmental Science & Pollution Research, 2024, v. 31, n. 57, p. 65661, doi. 10.1007/s11356-024-35620-9
- Adnani, Redouane E. L.;
- Roby, Othmane;
- Youbi, Boubaker;
- Lghazi, Youssef;
- Aynaou, Aziz;
- Waderhman, Keltoum;
- Tighadouini, Said;
- Alzahrani, Abdullah Yahya Abdullah;
- Saddik, Rafik;
- Bimaghra, Itto
- Article
36
- Journal of Materials Science, 2025, v. 60, n. 10, p. 4669, doi. 10.1007/s10853-025-10721-z
- Yang, Jia;
- Sun, Liang;
- He, Zhi;
- Xu, Wenzhen;
- Peng, Jianhong
- Article
37
- Theoretical Foundations of Chemical Engineering, 2024, v. 58, n. 3, p. 578, doi. 10.1134/S0040579524600979
- Grigoreva, E. A.;
- Matveychuk, Y. V.
- Article
38
- Theoretical Foundations of Chemical Engineering, 2024, v. 58, n. 2, p. 308, doi. 10.1134/S0040579524700519
- Sidorov, D. V.;
- Kirilin, A. D.;
- Shavnev, A. A.
- Article
39
- Journal of Chemical Crystallography, 2025, v. 55, n. 2, p. 115, doi. 10.1007/s10870-025-01043-8
- Kumari, Neha;
- Singh, Daljeet;
- Yadav, Archana Akaram;
- Sankpal, Sandeep Ashok;
- Murugavel, Saminathan;
- Lakshmanan, Duraiswamy;
- Kant, Rajni
- Article
40
- Journal of Structural Chemistry, 2025, v. 66, n. 4, p. 669, doi. 10.1134/S0022476625040031
- Khainovsky, M. A.;
- Sharaya, S. S.;
- Bogdanov, N. E.
- Article
41
- Journal of Structural Chemistry, 2025, v. 66, n. 2, p. 282, doi. 10.1134/S0022476625020076
- Abdulsamad, L. A.;
- Kanmazalp, S. D.;
- Jasim, S. S.;
- Abdelhamid, A. A.
- Article
42
- Journal of Structural Chemistry, 2024, v. 65, n. 12, p. 2567, doi. 10.1134/S0022476624120199
- Pavlov, D. I.;
- Ryadun, A. A.;
- Fedin, V. P.;
- Potapov, A. S.
- Article
43
- Journal of Structural Chemistry, 2024, v. 65, n. 11, p. 2198, doi. 10.1134/S0022476624110088
- Sartakova, A. V.;
- Makarenko, A. M.;
- Kuratieva, N. V.;
- Zherikova, K. V.
- Article
44
- Scientific Reports, 2024, v. 14, n. 1, p. 1, doi. 10.1038/s41598-024-83416-1
- Bauerhenne, Bernd;
- Garcia, Martin E.
- Article
45
- Scientific Reports, 2024, v. 14, n. 1, p. 1, doi. 10.1038/s41598-024-82347-1
- Beigiazaraghbelagh, Parvin;
- Rostamizadeh, Shahnaz;
- Poursattar Marjani, Ahmad;
- Bahrami, Aidin;
- Ghiasvand, Arezu;
- Arabi, Zahra
- Article
46
- Nature Communications, 2025, v. 16, n. 1, p. 1, doi. 10.1038/s41467-025-59057-x
- Sahu, Samrat;
- Paikin, Zachary E.;
- Talbott, John M.;
- Czabala, Patrick;
- Raj, Monika
- Article
47
- Nature Communications, 2025, v. 16, n. 1, p. 1, doi. 10.1038/s41467-025-57670-4
- Huang, Ende;
- Zhong, Licheng;
- Xue, Jingning;
- Zhou, Xiaohu;
- Liu, Siyue;
- Che, Li;
- Li, Hongwei;
- Fan, Hongjun;
- Dong, Wenrui;
- Yang, Xueming
- Article
48
- Nature Communications, 2025, v. 16, n. 1, p. 1, doi. 10.1038/s41467-025-57086-0
- Ayasli, Atilay;
- Khan, Arnab;
- Gstir, Thomas;
- Michaelsen, Tim;
- Papp, Dóra;
- Wang, Yan;
- Song, Hongwei;
- Yang, Minghui;
- Czakó, Gábor;
- Wester, Roland
- Article
49
- Nature Communications, 2025, v. 16, n. 1, p. 1, doi. 10.1038/s41467-025-57479-1
- Zhou, Dong;
- Bier, Imanuel;
- Santra, Biswajit;
- Jacobson, Leif D.;
- Wu, Chuanjie;
- Garaizar Suarez, Adiran;
- Almaguer, Barbara Ramirez;
- Yu, Haoyu;
- Abel, Robert;
- Friesner, Richard A.;
- Wang, Lingle
- Article
50
- Nature Communications, 2025, v. 16, n. 1, p. 1, doi. 10.1038/s41467-025-57134-9
- Rath, Yannic;
- Booth, George H.
- Article