Works matching DE "DENSITY functional theory"
1
- Scientific Reports, 2025, v. 15, n. 1, p. 1, doi. 10.1038/s41598-025-91458-2
- Tarekuzzaman, Md.;
- Ishraq, Md. Hasin;
- Shahadath, Nazmul;
- Kabir, Md. Raihan;
- Rayhan, M. A.;
- Ahmad, Sohail;
- Qader, Md. Abdul;
- Rasheduzzaman, Md.;
- Arafat, Yasir;
- Hasan, Md. Zahid
- Article
2
- Scientific Reports, 2025, v. 15, n. 1, p. 1, doi. 10.1038/s41598-025-06720-4
- Alassaf, Nahla A.;
- Hamody, Azhar S.;
- Jabir, Majid S.;
- Ghotekar, Suresh;
- Swelum, Ayman A.
- Article
3
- European Journal of Organic Chemistry, 2025, v. 28, n. 26, p. 1, doi. 10.1002/ejoc.202500291
- González, Claudia;
- De Nisco, Mauro;
- Lemos, Reinier;
- Cimmino, Giovanna;
- Pérez‐Badell, Yoana;
- Pacifico, Severina;
- Pedatella, Silvana
- Article
4
- Chemistry - An Asian Journal, 2025, v. 20, n. 13, p. 1, doi. 10.1002/asia.202500320
- Article
5
- ChemElectroChem, 2025, v. 12, n. 14, p. 1, doi. 10.1002/celc.202500095
- Yin, Lihong;
- Feng, Jinxian;
- Ip, Weng Fai;
- Luo, Guangfu;
- Pan, Hui
- Article
6
- Crystal Research & Technology, 2025, v. 60, n. 7, p. 1, doi. 10.1002/crat.202400261
- Chandran, Saravanan;
- Nattudurai, Ravikumar;
- Sathiyadhas Amalapushpam, Martin Britto Dhas;
- Kima, Ikhyun;
- Kandasamy, Anitha;
- Mayandi, Jeyanthinath
- Article
7
- ChemCatChem, 2025, v. 17, n. 13, p. 1, doi. 10.1002/cctc.202401097
- Huang, Hong;
- Guo, Zhongyuan;
- Wei, Li;
- Xiong, Wei;
- Li, Hao
- Article
8
- Polymers (20734360), 2025, v. 17, n. 13, p. 1834, doi. 10.3390/polym17131834
- Fernández, Joaquín Alejandro Hernández;
- Paternina, Katherine Liset Ortiz;
- Cano-Cuadro, Heidis
- Article
9
- Energies (19961073), 2025, v. 18, n. 13, p. 3537, doi. 10.3390/en18133537
- Wu, Zhaoguo;
- Wang, Qian;
- Huang, Huixian;
- Li, Yong;
- Kuang, Yulai;
- Xiang, Hong;
- Liu, Junwei;
- Cao, Zhengqin
- Article
10
- Materials (1996-1944), 2025, v. 18, n. 13, p. 3176, doi. 10.3390/ma18133176
- Wen, Yufeng;
- Yu, Yanlin;
- Gu, Huaizhang;
- Wang, Guilian;
- Yuan, Fangqiang
- Article
11
- Materials (1996-1944), 2025, v. 18, n. 13, p. 3153, doi. 10.3390/ma18133153
- Kishkentayeva, Anarkul;
- Kopbalina, Kymbat;
- Shaimerdenova, Zhanar;
- Shults, Elvira;
- Gatilov, Yury;
- Pankin, Dmitrii;
- Smirnov, Mikhail;
- Povolotckaia, Anastasia;
- Turdybekov, Dastan;
- Mazhenov, Nurlan
- Article
12
- Materials (1996-1944), 2025, v. 18, n. 13, p. 3103, doi. 10.3390/ma18133103
- Martuza, Kazi Golam;
- Kumar, Yogendra;
- Yamaguchi, Hiroshi;
- Kumar, Shiv;
- Arita, Masashi;
- Sato, Hitoshi;
- Ideta, Shin-ichiro;
- Shimada, Kenya
- Article
13
- Materials (1996-1944), 2025, v. 18, n. 13, p. 3042, doi. 10.3390/ma18133042
- Shi, Chenying;
- Yang, Biaobiao;
- Liu, Yuling;
- Shao, Wei;
- Li, Yidi;
- Li, Yunping;
- Zeng, Dewen;
- Du, Yong
- Article
14
- Materials (1996-1944), 2025, v. 18, n. 13, p. 2995, doi. 10.3390/ma18132995
- Shi, Lu;
- Liu, Min;
- Xie, Shangrui;
- Li, Song;
- Liu, Shuxin;
- Yuan, Shen;
- Duan, Xiaohui;
- Li, Hongzhen
- Article
15
- Materials (1996-1944), 2025, v. 18, n. 13, p. 2938, doi. 10.3390/ma18132938
- Article
16
- Molecules, 2025, v. 30, n. 13, p. 2887, doi. 10.3390/molecules30132887
- Wang, Feng;
- Chong, Delano P.
- Article
17
- Molecules, 2025, v. 30, n. 13, p. 2834, doi. 10.3390/molecules30132834
- Dudik, Alexander S.;
- Zanakhov, Timur O.;
- Galenko, Ekaterina E.;
- Novikov, Mikhail S.;
- Khlebnikov, Alexander F.
- Article
18
- Molecules, 2025, v. 30, n. 13, p. 2820, doi. 10.3390/molecules30132820
- Shi, Wei;
- Li, Renwei;
- Yang, Haifeng;
- Kong, Dehao;
- Chen, Qicheng
- Article
19
- Molecules, 2025, v. 30, n. 13, p. 2776, doi. 10.3390/molecules30132776
- Abdallah, Abanoub Mosaad;
- Wolff, Mariusz;
- Leygue, Nadine;
- Deleuzière, Maëlle;
- Saffon-Merceron, Nathalie;
- Serpentini, Charles-Louis;
- Benoist, Eric;
- Fery-Forgues, Suzanne
- Article
20
- Molecules, 2025, v. 30, n. 13, p. 2732, doi. 10.3390/molecules30132732
- Venkataramanan, Natarajan Sathiyamoorthy;
- Suvitha, Ambigapathy;
- Sahara, Ryoji
- Article
21
- Molecules, 2025, v. 30, n. 13, p. 2693, doi. 10.3390/molecules30132693
- Sener, Sevil;
- Acar-Selcuki, Nursel
- Article
22
- Molecules, 2025, v. 30, n. 13, p. 2684, doi. 10.3390/molecules30132684
- Vrban, Lucija;
- Martinac, Ingrid Ana;
- Hranjec, Marijana;
- Pocrnić, Marijana;
- Galić, Nives;
- Kobetić, Renata;
- Vianello, Robert
- Article
23
- International Journal of Molecular Sciences, 2025, v. 26, n. 13, p. 6325, doi. 10.3390/ijms26136325
- Article
24
- International Journal of Molecular Sciences, 2025, v. 26, n. 13, p. 6085, doi. 10.3390/ijms26136085
- Kujawski, Jacek;
- Drabińska, Beata;
- Dettlaff, Katarzyna;
- Skotnicki, Marcin;
- Olszewska, Agata;
- Ratajczak, Tomasz;
- Napierała, Marianna;
- Chmielewski, Marcin K.;
- Kasprzak, Milena;
- Kujawski, Radosław;
- Gostyńska-Stawna, Aleksandra;
- Stawny, Maciej
- Article
25
- Scientific Reports, 2025, v. 15, n. 1, p. 1, doi. 10.1038/s41598-025-08421-4
- Ungeheuer, Katarzyna;
- Bocirnea, Amelia E.;
- Marszalek, Konstanty W.;
- Tokarz, Waldemar;
- Pikulski, Denis A.;
- Kąkol, Zbigniew;
- Galca, Aurelian C.
- Article
26
- Scientific Reports, 2025, v. 15, n. 1, p. 1, doi. 10.1038/s41598-025-11191-8
- Mikaeilzadeh, Leila;
- Khoeini, Farhad;
- Tavana, Ali
- Article
27
- Nanomaterials (2079-4991), 2025, v. 15, n. 13, p. 1012, doi. 10.3390/nano15131012
- Sai, Linwei;
- Du, Beiran;
- Fu, Li;
- Akter, Sultana;
- Tang, Chunmei;
- Zhao, Jijun
- Article
28
- Nanomaterials (2079-4991), 2025, v. 15, n. 13, p. 992, doi. 10.3390/nano15130992
- AlJaber, Ghada;
- AlShammari, Basheer;
- AlOtaibi, Bandar
- Article
29
- Nanomaterials (2079-4991), 2025, v. 15, n. 13, p. 979, doi. 10.3390/nano15130979
- Wang, Guanyu;
- Kou, Lihong;
- Li, Chenghao;
- Xu, Bing;
- Wu, Yuanfeng
- Article
30
- Applied Sciences (2076-3417), 2025, v. 15, n. 13, p. 7293, doi. 10.3390/app15137293
- Jiang, Feng;
- He, Shuai;
- Qi, Jiaxing;
- Luo, Yuanjia;
- Tang, Honghu
- Article
31
- Sensors (14248220), 2025, v. 25, n. 13, p. 4156, doi. 10.3390/s25134156
- Yang, Xu;
- Cui, Hao;
- Liu, Zhongchao;
- Liu, Yun
- Article
32
- Communications Physics, 2025, v. 8, n. 1, p. 1, doi. 10.1038/s42005-025-02190-2
- Kong, Dejia;
- Karbasizadeh, Siavash;
- Narasimha, Ganesh;
- Regmi, Paras;
- Tao, Chenggang;
- Mu, Sai;
- Vasudevan, Rama;
- Harrison, Ian;
- Jin, Rongying;
- Gai, Zheng
- Article
33
- NPJ Computational Materials, 2025, v. 11, n. 1, p. 1, doi. 10.1038/s41524-025-01656-9
- Larsen, Casper;
- Kaappa, Sami;
- Vishart, Andreas Lynge;
- Bligaard, Thomas;
- Jacobsen, Karsten Wedel
- Article
34
- International Journal of Modern Physics C: Computational Physics & Physical Computation, 2025, v. 36, n. 11, p. 1, doi. 10.1142/S0129183125500184
- Badaoui, Abdelhamid;
- Menni, Younes;
- Hanoon, Falah H.;
- Bayram, Mustafa;
- Ikumapayi, Omolayo M.
- Article
35
- Journal of Electronic Materials, 2025, v. 54, n. 8, p. 6616, doi. 10.1007/s11664-025-12073-5
- Mushtaq, Maimoona;
- Jalil, Abdul;
- Khan, Raja Azhar Saeed;
- Aamir, Muhammad;
- Raza, Syed Raza Ali
- Article
36
- Journal of Electronic Materials, 2025, v. 54, n. 8, p. 6593, doi. 10.1007/s11664-025-12066-4
- Nguyen, Ngoc Linh;
- Dang, Hung The;
- Pham, Tien Lam;
- Nghiem, Thi Minh Hoa
- Article
37
- Journal of Electronic Materials, 2025, v. 54, n. 8, p. 6685, doi. 10.1007/s11664-025-12036-w
- Rahman, Mosfiqur;
- Akter, Mst. Afroza;
- Roshid, Md. Mamunur;
- Haq, Md. Monirul
- Article
38
- Journal of Electronic Materials, 2025, v. 54, n. 8, p. 6204, doi. 10.1007/s11664-025-12026-y
- Solanki, Kamal;
- Amina, Shubuhan;
- Majumder, Manoj Kumar
- Article
39
- Physica Status Solidi. A: Applications & Materials Science, 2025, v. 222, n. 13, p. 1, doi. 10.1002/pssa.202400906
- Özen, Leyla Babali;
- Özen, Furkan;
- Gündüz, Bayram;
- Cin, Günseli Turgut;
- Ekici, Öner
- Article
40
- Nature Communications, 2025, v. 16, n. 1, p. 1, doi. 10.1038/s41467-025-61591-7
- Lan, Xuhua;
- Geng, Lin;
- Zhang, Zhen;
- Li, Yunfei;
- Yuan, Jian;
- Zhou, Chen-Xu;
- Huang, Song;
- Hu, Ziyi;
- Li, Jing;
- Yang, Chengpeng;
- Zhang, Yong;
- Fan, Zhaochuan;
- Tian, Dan;
- Zhao, Xiaoxu;
- Li, Qingwen;
- Kang, Lixing
- Article
41
- Nature Communications, 2025, v. 16, n. 1, p. 1, doi. 10.1038/s41467-025-60805-2
- Midya, Suparnak;
- Ali, Aksar;
- Hari, Durga Prasad
- Article
42
- European Journal of Organic Chemistry, 2025, v. 28, n. 22, p. 1, doi. 10.1002/ejoc.202500192
- Pounder, Austin;
- King, Noah;
- Tam, William
- Article
43
- European Journal of Organic Chemistry, 2025, v. 28, n. 21, p. 1, doi. 10.1002/ejoc.202400679
- Pollák, Patrik;
- Milen, Mátyás;
- Volk, Balázs;
- Ábrányi‐Balogh, Péter
- Article
44
- European Journal of Organic Chemistry, 2025, v. 28, n. 20, p. 1, doi. 10.1002/ejoc.202500112
- Ota, Kei;
- Ikoma, Shotaro;
- Okuda, Tomohisa;
- Itakura, Taisei;
- Nakahodo, Tsukasa;
- Hashizume, Daisuke;
- Matsuo, Tsukasa
- Article
45
- European Journal of Organic Chemistry, 2025, v. 28, n. 17, p. 1, doi. 10.1002/ejoc.202500033
- Janssens, Julien;
- Berionni, Guillaume;
- Robiette, Raphaël
- Article
46
- Advanced Materials Interfaces, 2025, v. 12, n. 10, p. 1, doi. 10.1002/admi.202400897
- Stephen, Nicholas;
- Pinto‐Huguet, Ivan;
- Lawrence, Robert;
- Kepaptsoglou, Demie;
- Botifoll, Marc;
- Gocalinska, Agnieszka;
- Mura, Enrica;
- Ramasse, Quentin;
- Pelucchi, Emanuele;
- Arbiol, Jordi;
- Arredondo, Miryam
- Article
47
- Advanced Materials Interfaces, 2025, v. 12, n. 10, p. 1, doi. 10.1002/admi.202400904
- Kimura, Mitsuo;
- Kunisada, Yuji;
- Sugimoto, Yoshiaki
- Article
48
- Indoor Air, 2025, v. 2025, p. 1, doi. 10.1155/ina/1071778
- Duan, Xiaojian;
- Huang, Yuqi;
- Shen, Chao;
- Jones, Phil;
- Deng, Xi;
- Wang, Faming
- Article
49
- ChemCatChem, 2025, v. 17, n. 12, p. 1, doi. 10.1002/cctc.202500248
- Ghoshal, Sourav;
- Sarkar, Pranab
- Article
50
- ChemCatChem, 2025, v. 17, n. 12, p. 1, doi. 10.1002/cctc.202500096
- Krueger, Jan‐Dominik H.;
- Sivarajah, Dhanushiyaa.;
- Poller, Maximilian J.;
- Robinson, David.;
- Albert, Jakob.
- Article