Journal of Mathematical Chemistry Short Title: J. Math. Chem. Publisher: Springer International Publishing, Cham ISSN: 0259-9791; 1572-8897/e Online: https://link.springer.com/journal/10910/volumes-and-issues Comments: Journal; Indexed cover-to-cover Documents Indexed: 3,046 Publications (since 1994) References Indexed: 2,653 Publications with 91,623 References. all top 5 Latest Issues 62, No. 4 (2024) 62, No. 3 (2024) 62, No. 2 (2024) 62, No. 1 (2024) 61, No. 10 (2023) 61, No. 9 (2023) 61, No. 8 (2023) 61, No. 7 (2023) 61, No. 6 (2023) 61, No. 5 (2023) 61, No. 4 (2023) 61, No. 3 (2023) 61, No. 2 (2023) 61, No. 1 (2023) 60, No. 10 (2022) 60, No. 9 (2022) 60, No. 8 (2022) 60, No. 7 (2022) 60, No. 6 (2022) 60, No. 5 (2022) 60, No. 4 (2022) 60, No. 3 (2022) 60, No. 2 (2022) 60, No. 1 (2022) 59, No. 10 (2021) 59, No. 9 (2021) 59, No. 8 (2021) 59, No. 7 (2021) 59, No. 6 (2021) 59, No. 5 (2021) 59, No. 4 (2021) 59, No. 3 (2021) 59, No. 2 (2021) 59, No. 1 (2021) 58, No. 10 (2020) 58, No. 9 (2020) 58, No. 8 (2020) 58, No. 7 (2020) 58, No. 6 (2020) 58, No. 5 (2020) 58, No. 4 (2020) 58, No. 3 (2020) 58, No. 2 (2020) 58, No. 1 (2020) 57, No. 10 (2019) 57, No. 9 (2019) 57, No. 8 (2019) 57, No. 7 (2019) 57, No. 6 (2019) 57, No. 5 (2019) 57, No. 4 (2019) 57, No. 3 (2019) 57, No. 2 (2019) 57, No. 1 (2019) 56, No. 10 (2018) 56, No. 9 (2018) 56, No. 8 (2018) 56, No. 7 (2018) 56, No. 6 (2018) 56, No. 5 (2018) 56, No. 4 (2018) 56, No. 3 (2018) 56, No. 2 (2018) 56, No. 1 (2018) 55, No. 10 (2017) 55, No. 9 (2017) 55, No. 8 (2017) 55, No. 7 (2017) 55, No. 6 (2017) 55, No. 5 (2017) 55, No. 4 (2017) 55, No. 3 (2017) 55, No. 2 (2017) 55, No. 1 (2017) 54, No. 10 (2016) 54, No. 9 (2016) 54, No. 8 (2016) 54, No. 7 (2016) 54, No. 6 (2016) 54, No. 5 (2016) 54, No. 4 (2016) 54, No. 3 (2016) 54, No. 2 (2016) 54, No. 1 (2016) 53, No. 10 (2015) 53, No. 9 (2015) 53, No. 8 (2015) 53, No. 7 (2015) 53, No. 6 (2015) 53, No. 5 (2015) 53, No. 4 (2015) 53, No. 3 (2015) 53, No. 2 (2015) 53, No. 1 (2015) 52, No. 10 (2014) 52, No. 9 (2014) 52, No. 8 (2014) 52, No. 7 (2014) 52, No. 6 (2014) 52, No. 5 (2014) ...and 140 more Volumes all top 5 Authors 162 Simos, Theodore E. 112 Carbó-Dorca, Ramon 51 Belkić, Dževad 41 Demiralp, Metin 39 Belkić, Karen 35 Nalewajski, Roman F. 33 Fujita, Shinsaku 32 Mezey, Paul G. 31 Fernández, Francisco Marcelo 30 Besalú, Emili 29 Gutman, Ivan M. 28 Alolyan, Ibraheem 28 Ivanauskas, Feliksas. F. 27 Balasubramanian, Krishnan 26 Lim, Teik-Cheng 25 Rabitz, Herschel A. 22 Vigo-Aguiar, Jesus 22 Zhang, Heping 21 Castro, Eduardo A. 21 Klein, Douglas J. 21 March, Norman H. 21 Rosenfeld, Vladimir Raphael 20 Mamedov, Bahtiyar A. 20 Zhou, Bo 19 Arimoto, Shigeru 19 Lin, Chialiang 19 Sever, Ramazan 19 Trinajstić, Nenad 18 Fang, Yonglei 18 Marmorino, M. G. 18 Vukičević, Damir 17 Bucknum, Michael John 17 Diudea, Mircea V. 17 Zhang, Fuji 16 Berberan-Santos, Mário N. 16 Došlić, Tomislav 15 Cordero, Alicia 15 Magreñán, Ángel Alberto 15 Merkin, John H. 15 Torregrosa Sanchez, Juan Ramón 14 Baronas, Romas 14 Randić, Milan 14 Varon, Ramón 13 Jia, Jiteng 13 Roul, Pradip 13 Sigarreta Almira, José María 12 Ayers, Paul W. 12 Cassam-Chenaï, Patrick 12 Chen, Lansun 12 Garcia-Moreno, Manuela 12 Guseinov, Israfil I. 12 Hill, James Murray 12 Medvedev, Maxim A. 12 Strekalov, Mikhail L. 11 Argyros, Ioannis Konstantinos 11 Baowan, Duangkamon 11 Deng, Hanyuan 11 Flores-Gallegos, Nelson 11 Li, Genyuan 11 Macías-Díaz, Jorge Eduardo 11 Pogliani, Lionello 11 Ramos, Higinio 11 Sidhu, Harvinder Singh 11 Wang, Guichang 11 Xu, Xiufang 11 Zhao, Xuezhuang 11 Živković, Tomislav P. 10 Anastassi, Zacharias A. 10 Balaban, Alexandru T. 10 Karimi, Sasan 10 Kulys, Juozas 10 Lewinter, Marty 10 Li, Ruifang 10 Mendoza, Eduardo R. 10 Rajendran, L. 10 Rodríguez García, José Manuel 10 Skakauskas, Vladas 10 Taşeli, Hasan 10 You, Xiong 9 Arribas, Enrique 9 Avery, John Scales 9 Bayón, Luis 9 Gubernov, Vladimir Vladimirovich 9 Li, Risong 9 Medvedeva, Marina A. 9 Paldus, Josef 9 Shang, Zhenfeng 9 Sicilia, Juan Antonio 9 Singh, Randhir 9 Suárez, Pedro Maria 9 Szederkényi, Gábor 9 Temme, F. P. 9 Wazwaz, Abdul-Majid Abdul-Rahman 8 Arteca, Gustavo A. 8 Banerjee, Kinshuk 8 Brinkmann, Gunnar 8 Chakraborty, Tanmoy 8 Chauvin, Remi 8 Cox, Barry James 8 Dehesa, Jesús S. ...and 3,143 more Authors all top 5 Fields 1,716 Biology and other natural sciences (92-XX) 811 Quantum theory (81-XX) 527 Numerical analysis (65-XX) 441 Combinatorics (05-XX) 262 Ordinary differential equations (34-XX) 240 Partial differential equations (35-XX) 223 Statistical mechanics, structure of matter (82-XX) 126 Classical thermodynamics, heat transfer (80-XX) 121 Dynamical systems and ergodic theory (37-XX) 79 Statistics (62-XX) 72 Special functions (33-XX) 69 Linear and multilinear algebra; matrix theory (15-XX) 67 Probability theory and stochastic processes (60-XX) 67 Information and communication theory, circuits (94-XX) 48 Optics, electromagnetic theory (78-XX) 47 Group theory and generalizations (20-XX) 47 Fluid mechanics (76-XX) 46 Approximations and expansions (41-XX) 45 Operator theory (47-XX) 40 Mechanics of particles and systems (70-XX) 35 Convex and discrete geometry (52-XX) 35 Computer science (68-XX) 32 Calculus of variations and optimal control; optimization (49-XX) 30 Systems theory; control (93-XX) 26 Manifolds and cell complexes (57-XX) 25 General and overarching topics; collections (00-XX) 25 Harmonic analysis on Euclidean spaces (42-XX) 25 Operations research, mathematical programming (90-XX) 23 Mechanics of deformable solids (74-XX) 21 Number theory (11-XX) 20 Topological groups, Lie groups (22-XX) 20 Functional analysis (46-XX) 19 Real functions (26-XX) 17 Integral transforms, operational calculus (44-XX) 16 Geometry (51-XX) 15 Integral equations (45-XX) 12 Difference and functional equations (39-XX) 11 Global analysis, analysis on manifolds (58-XX) 9 Differential geometry (53-XX) 8 Mathematical logic and foundations (03-XX) 8 Algebraic geometry (14-XX) 8 Functions of a complex variable (30-XX) 8 Sequences, series, summability (40-XX) 8 General topology (54-XX) 8 Relativity and gravitational theory (83-XX) 7 Order, lattices, ordered algebraic structures (06-XX) 7 Measure and integration (28-XX) 7 Astronomy and astrophysics (85-XX) 6 Associative rings and algebras (16-XX) 6 Game theory, economics, finance, and other social and behavioral sciences (91-XX) 5 Nonassociative rings and algebras (17-XX) 5 Potential theory (31-XX) 4 History and biography (01-XX) 4 Commutative algebra (13-XX) 4 Geophysics (86-XX) 2 Several complex variables and analytic spaces (32-XX) 2 Abstract harmonic analysis (43-XX) 2 Algebraic topology (55-XX) 1 \(K\)-theory (19-XX) Publications by Year all cited Publications top 5 cited Publications Citations contained in zbMATH Open 1,995 Publications have been cited 15,197 times in 5,669 Documents Cited by ▼ Year ▼ A forgotten topological index. Zbl 1317.05031 Furtula, Boris; Gutman, Ivan 176 2015 Topological index based on the ratios of geometrical and arithmetical means of end-vertex degrees of edges. Zbl 1200.92054 Vukičević, Damir; Furtula, Boris 160 2009 On a novel connectivity index. Zbl 1197.92060 Zhou, Bo; Trinajstić, Nenad 136 2009 On general sum-connectivity index. Zbl 1195.92083 Zhou, Bo; Trinajstić, Nenad 133 2010 General foundations of high-dimensional model representations. Zbl 0957.93004 Rabitz, Herschel; Alış, Ömer F. 128 1999 A Runge-Kutta type implicit high algebraic order two-step method with vanished phase-lag and its first, second, third and fourth derivatives for the numerical solution of coupled differential equations arising from the Schrödinger equation. Zbl 1318.65039 Mu, Kenan; Simos, T. E. 98 2015 A new two-step hybrid method for the numerical solution of the Schrödinger equation. Zbl 1200.81051 Konguetsof, A. 95 2010 A new Numerov-type method for the numerical solution of the Schrödinger equation. Zbl 1183.81060 Simos, T. E. 95 2009 A new two stage symmetric two-step method with vanished phase-lag and its first, second, third and fourth derivatives for the numerical solution of the radial Schrödinger equation. Zbl 1349.65222 Zhou, Zhou; Simos, T. E. 95 2016 A family of two-stage two-step methods for the numerical integration of the Schrödinger equation and related IVPs with oscillating solution. Zbl 1198.81075 Anastassi, Z. A.; Simos, T. E. 94 2009 A modified phase-fitted Runge-Kutta method for the numerical solution of the Schrödinger equation. Zbl 1003.65082 Simos, T. E.; Aguiar, Jesus Vigo 92 2001 A new family of two stage symmetric two-step methods with vanished phase-lag and its derivatives for the numerical integration of the Schrödinger equation. Zbl 1329.65142 Hui, Fei; Simos, T. E. 91 2015 Symmetric eighth algebraic order methods with minimal phase-lag for the numerical solution of the Schrödinger equation. Zbl 1002.65078 Simos, T. E.; Vigo-Aguiar, Jesus 91 2002 Trigonometrically fitted Runge-Kutta methods for the numerical solution of the Schrödinger equation. Zbl 1070.81035 Anastassi, Z. A.; Simos, T. E. 89 2005 Augmented Zagreb index. Zbl 1196.92050 Furtula, Boris; Graovac, Ante; Vukičević, Damir 89 2010 Two optimized symmetric eight-step implicit methods for initial-value problems with oscillating solutions. Zbl 1198.81099 Panopoulos, G. A.; Anastassi, Z. A.; Simos, T. E. 86 2009 Two-step high order hybrid explicit method for the numerical solution of the Schrödinger equation. Zbl 1198.81092 Konguetsof, A. 85 2010 Family of twelve steps exponential fitting symmetric multistep methods for the numerical solution of the Schrödinger equation. Zbl 1014.81055 Vigo-Aguiar, J.; Simos, T. E. 84 2002 Construction of trigonometrically and exponentially fitted Runge–Kutta–Nyström methods for the numerical solution of the Schrödinger equation and related problems – a method of 8th algebraic order. Zbl 1002.65077 Kalogiratou, Z.; Simos, T. E. 81 2002 A low computational cost eight algebraic order hybrid method with vanished phase-lag and its first, second, third and fourth derivatives for the approximate solution of the Schrödinger equation. Zbl 1331.65098 Ning, Hang; Simos, T. E. 77 2015 High order closed Newton-Cotes exponentially and trigonometrically fitted formulae as multilayer symplectic integrators and their application to the radial Schrödinger equation. Zbl 1403.81016 Simos, T. E. 76 2012 A family of multiderivative methods for the numerical solution of the Schrödinger equation. Zbl 1070.81045 Sakas, D. P.; Simos, T. E. 76 2005 Exponentially-fitted multiderivative methods for the numerical solution of the Schrödinger equation. Zbl 1050.65074 Simos, T. E. 75 2004 An economical eighth-order method for the approximation of the solution of the Schrödinger equation. Zbl 1422.65115 Wang, Zhiwei; Simos, T. E. 75 2017 A family of exponentially-fitted Runge-Kutta methods with exponential order up to three for the numerical solution of the Schrödinger equation. Zbl 1125.81017 Anastassi, Z. A.; Simos, T. E. 74 2007 A new explicit Bessel and Neumann fitted eighth algebraic order method for the numerical solution of the Schrödinger equation. Zbl 1014.81012 Simos, T. E. 74 2000 Symplectic methods for the numerical solution of the radial Schrödinger equation. Zbl 1029.65134 Tselios, Kostas; Simos, T. E. 74 2003 A generator and an optimized generator of high-order hybrid explicit methods for the numerical solution of the Schrödinger equation. II: Development of the generator, optimization of the generator and numerical results. Zbl 1022.81009 Avdelas, G.; Konguetsof, A.; Simos, T. E. 73 2001 New P-stable eighth algebraic order exponentially-fitted methods for the numerical integration of the Schrödinger equation. Zbl 1078.65061 Avdelas, G.; Kefalidis, E.; Simos, T. E. 73 2002 A family of trigonometrically-fitted symmetric methods for the efficient solution of the Schrödinger equation and related problems. Zbl 1029.65079 Simos, T. E. 72 2003 A generator and an optimized generator of high-order hybrid explicit methods for the numerical solution of the Schrödinger equation. I: Development of the basic method. Zbl 1022.81008 Avdelas, G.; Konguetsof, A.; Simos, T. E. 71 2001 Exponentially fitted symplectic methods for the numerical integration of the Schrödinger equation. Zbl 1073.65071 Monovasilis, Th.; Kalogiratou, Z.; Simos, T. E. 71 2005 New high order multiderivative explicit four-step methods with vanished phase-lag and its derivatives for the approximate solution of the Schrödinger equation. I: construction and theoretical analysis. Zbl 1270.81083 Simos, T. E. 71 2013 Sixth algebraic order trigonometrically fitted predictor-corrector methods for the numerical solution of the radial Schrödinger equation. Zbl 1070.81044 Psihoyios, G.; Simos, T. E. 70 2005 Trigonometrically fitted and exponentially fitted symplectic methods for the numerical integration of the Schrödinger equation. Zbl 1125.81021 Monovasilis, Th.; Kalogiratou, Z.; Monovasilis, Th.; Simos, T. E. 69 2006 Symplectic methods of fifth order for the numerical solution of the radial Schrödinger equation. Zbl 1044.81031 Tselios, Kostas; Simos, T. E. 68 2004 A finite difference pair with improved phase and stability properties. Zbl 1384.65050 Yan, Ke; Simos, T. E. 67 2018 An explicit four-step method with vanished phase-lag and its first and second derivatives. Zbl 1297.65084 Simos, T. E. 64 2014 The numerical solution of the radial Schrödinger equation via a trigonometrically fitted family of seventh algebraic order predictor-corrector methods. Zbl 1125.81022 Psihoyios, G.; Simos, T. E. 62 2006 New second-order exponentially and trigonometrically fitted symplectic integrators for the numerical solution of the time-independent Schrödinger equation. Zbl 1132.81344 Monovasilis, Th.; Simos, T. E. 62 2007 A Runge-Kutta type four-step method with vanished phase-lag and its first and second derivatives for each level for the numerical integration of the Schrödinger equation. Zbl 1300.65050 Alolyan, Ibraheem; Simos, T. E. 62 2014 A four-step exponentially fitted method for the numerical solution of the Schrödinger equation. Zbl 1125.81023 Simos, T. E. 61 2006 An optimized explicit Runge-Kutta method with increased phase-lag order for the numerical solution of the Schrödinger equation and related problems. Zbl 1200.81052 Kosti, A. A.; Anastassi, Z. A.; Simos, T. E. 57 2010 A hybrid type four-step method with vanished phase-lag and its first, second and third derivatives for each level for the numerical integration of the Schrödinger equation. Zbl 1307.65106 Alolyan, Ibraheem; Simos, T. E. 57 2014 A family of explicit linear six-step methods with vanished phase-lag and its first derivative. Zbl 1301.65068 Alolyan, Ibraheem; Simos, T. E. 56 2014 Efficient low computational cost hybrid explicit four-step method with vanished phase-lag and its first, second, third and fourth derivatives for the numerical integration of the Schrödinger equation. Zbl 1325.65099 Alolyan, Ibraheem; Simos, T. E. 55 2015 Closed Newton-Cotes trigonometrically-fitted formulae of high order for the numerical integration of the Schrödinger equation. Zbl 1217.65054 Simos, T. E. 54 2008 Unicyclic graphs with minimal energy. Zbl 0977.05085 Hou, Yaoping 54 2001 A unification of chirality measures. Zbl 0865.92026 Weinberg, Noham; Mislow, Kurt 52 1995 A new explicit hybrid four-step method with vanished phase-lag and its derivatives. Zbl 1297.65085 Simos, T. E. 52 2014 Solving coupled Lane-Emden boundary value problems in catalytic diffusion reactions by the Adomian decomposition method. Zbl 1311.92222 Rach, Randolph; Duan, Jun-Sheng; Wazwaz, Abdul-Majid 52 2014 A family of four-step trigonometrically-fitted methods and its application to the Schrödinger equation. Zbl 1217.65139 Simos, T. E. 51 2008 Cyclical edge-connectivity of fullerene graphs and \((k,6)\)-cages. Zbl 1018.92036 Došlić, Tomislav 51 2003 A new four stages symmetric two-step method with vanished phase-lag and its first derivative for the numerical integration of the Schrödinger equation. Zbl 1345.65048 Liang, Minjian; Simos, T. E. 50 2016 Efficient implementation of high dimensional model representations. Zbl 1051.93502 Alis, Ömer F.; Rabitz, Herschel 49 2001 Identifiability of chemical reaction networks. Zbl 1145.92040 Craciun, Gheorghe; Pantea, Casian 49 2008 A hybrid method with phase-lag and derivatives equal to zero for the numerical integration of the Schrödinger equation. Zbl 1304.65170 Konguetsof, A. 48 2011 A high algebraic order multistage explicit four-step method with vanished phase-lag and its first, second, third, fourth and fifth derivatives for the numerical solution of the Schrödinger equation. Zbl 1325.65100 Alolyan, Ibraheem; Simos, T. E. 48 2015 Some embedded modified Runge-Kutta methods for the numerical solution of some specific Schrödinger equations. Zbl 0915.65084 Simos, T. E. 47 1998 A predictor-corrector explicit four-step method with vanished phase-lag and its first, second and third derivatives for the numerical integration of the Schrödinger equation. Zbl 1318.65042 Alolyan, Ibraheem; Simos, T. E. 47 2015 A high algebraic order predictor-corrector explicit method with vanished phase-lag and its first, second, third and fourth derivatives for the numerical solution of the Schrödinger equation and related problems. Zbl 1331.65093 Alolyan, Ibraheem; Simos, T. E. 47 2015 Exponential Fitting method for the time-dependent Schrödinger equation. Zbl 1198.81100 Rizea, M. 47 2010 A two-step method with vanished phase-lag and its first two derivatives for the numerical solution of the Schrödinger equation. Zbl 1304.65177 Simos, T. E. 46 2011 Kinetic approach to chemical reactions and inelastic transitions in a rarefied gas. Zbl 1048.92502 Groppi, M.; Spiga, G. 45 1999 A second-order scheme for the “Brusselator” reaction-diffusion system. Zbl 1016.92049 Twizell, E. H.; Gumel, A. B.; Cao, Q. 45 2000 A new optimized symmetric 8-step semi-embedded predictor-corrector method for the numerical solution of the radial Schrödinger equation and related orbital problems. Zbl 1312.65117 Panopoulos, G. A.; Simos, T. E. 45 2013 Dynamic analysis of Michaelis-Menten chemostat-type competition models with time delay and pulse in a polluted environment. Zbl 1194.92075 Meng, Xinzhu; Li, Zhenqing; Nieto, Juan J. 44 2010 A generator of families of two-step numerical methods with free parameters and minimal phase-lag. Zbl 1421.65017 Konguetsof, A. 44 2017 A three-stages multistep teeming in phase algorithm for computational problems in chemistry. Zbl 1417.81172 Medvedev, Maxim A.; Simos, T. E. 42 2019 An efficient and computational effective method for second order problems. Zbl 1422.65113 Ma, Jing; Simos, T. E. 41 2017 Bifurcation analysis of reaction-diffusion Schnakenberg model. Zbl 1320.92088 Liu, Ping; Shi, Junping; Wang, Yuwen; Feng, Xiuhong 39 2013 Mostar index. Zbl 1406.92750 Došlić, Tomislav; Martinjak, Ivica; Škrekovski, Riste; Tipurić Spužević, Sanja; Zubac, Ivana 38 2018 Monotone chemical reaction networks. Zbl 1117.80309 De Leenheer, Patrick; Angeli, David; Sontag, Eduardo D. 36 2007 The Estrada index of chemical trees. Zbl 1309.92085 Ilić, Aleksandar; Stevanović, Dragan 35 2010 A family of P-stable eighth algebraic order methods with exponential fitting facilities. Zbl 0995.81506 Aguiar, J. V.; Simos, T. E. 35 2001 A new high algebraic order four stages symmetric two-step method with vanished phase-lag and its first and second derivatives for the numerical solution of the Schrödinger equation and related problems. Zbl 1360.65193 Xi, Xiaopeng; Simos, T. E. 35 2016 Bounds for the Kirchhoff index via majorization techniques. Zbl 1327.05066 Bianchi, Monica; Cornaro, Alessandra; Palacios, José Luis; Torriero, Anna 35 2013 Atoms of multistationarity in chemical reaction networks. Zbl 1352.92186 Joshi, Badal; Shiu, Anne 35 2013 Embedded eighth order methods for the numerical solution of the Schrödinger equation. Zbl 0954.65061 Avdelas, G.; Simos, T. E. 34 2000 On resistance-distance and Kirchhoff index. Zbl 1187.92092 Zhou, Bo; Trinajstić, Nenad 34 2009 High algebraic order methods with vanished phase-lag and its first derivative for the numerical solution of the Schrödinger equation. Zbl 1202.81027 Alolyan, Ibraheem; Simos, T. E. 34 2010 Minimum general sum-connectivity index of unicyclic graphs. Zbl 1293.05048 Du, Zhibin; Zhou, Bo; Trinajstić, Nenad 34 2010 A family of \(P\)-stable exponentially-fitted methods for the numerical solution of the Schrödinger equation. Zbl 0954.65064 Simos, T. E. 33 1999 Dynamic behaviors of Monod type chemostat model with impulsive perturbation on the nutrient concentration. Zbl 1217.34125 Sun, Shulin; Chen, Lansun 33 2007 On Harary index. Zbl 1217.05216 Zhou, Bo; Cai, Xiaochun; Trinajstić, Nenad 33 2008 Bifurcation analysis and chaos control in discrete-time glycolysis models. Zbl 1384.92030 Din, Qamar 33 2018 High dimensional model representations generated from low dimensional data samples. I: mp-cut-HDMR. Zbl 1023.81521 Li, Genyuan; Wang, Sheng-Wei; Rosenthal, Carey; Rabitz, Herschel 33 2001 Terminal Wiener index. Zbl 1310.05075 Gutman, Ivan; Furtula, Boris; Petrović, Miroslav 33 2009 Eighth order methods with minimal phase-lag for accurate computations for the elastic scattering phase-shift problem. Zbl 0900.81031 Simos, T. E. 33 1997 Extremal values of the Sombor index in unicyclic and bicyclic graphs. Zbl 1462.05071 Cruz, Roberto; Rada, Juan 33 2021 Landscapes and their correlation functions. Zbl 1002.92547 Stadler, Peter F. 32 1996 A constructive approach to quasi-steady state reductions. Zbl 1331.92172 Goeke, Alexandra; Walcher, Sebastian 32 2014 A Haar wavelet-finite difference hybrid method for the numerical solution of the modified Burgers’ equation. Zbl 1331.65123 Oruç, Ö.; Bulut, F.; Esen, A. 32 2015 The ABC matrix. Zbl 1380.92097 Estrada, Ernesto 31 2017 On lower bounds of number of perfect matchings in fullerene graphs. Zbl 0918.92025 Došlić, Tomislav 30 1998 Mulitstep methods with vanished phase-lag and its first and second derivatives for the numerical integration of the Schrödinger equation. Zbl 1202.81028 Alolyan, Ibraheem; Simos, T. E. 30 2010 On the convergence of Mickens’ type nonstandard finite difference schemes on Lane-Emden type equations. Zbl 1448.65121 Verma, Amit Kumar; Kayenat, Sheerin 30 2018 Taylor series solution for Lane-Emden equation. Zbl 1429.34027 He, Ji-Huan; Ji, Fei-Yu 30 2019 Global stability of complex balanced mechanisms. Zbl 1012.92046 Siegel, D.; MacLean, D. 29 2000 On the permanental polynomials of some graphs. Zbl 1048.05062 Yan, Weigen; Zhang, Fuji 29 2004 Theoretical model for the prediction of lattice energy of diatomic metal halides. Zbl 07796554 Pandey, Anjani K.; Dixit, Chandra K.; Srivastava, Shivam 1 2024 Solution to quantum chemistry problems using a phase-fitting, singularly P-stable, cost-effective two-step approach with disappearing phase-lag derivatives up to order 5. Zbl 1512.65141 Sun, Bin; Lin, Chia-Liang; Simos, T. E. 6 2023 Highly efficient, singularly P-stable, and low-cost phase-fitting two-step method of 14th order for problems in chemistry. Zbl 1515.65196 Lin, Chia-Liang; Simos, T. E. 4 2023 A close-up to the bond-breaking and bond-forming using information theory. Zbl 1521.81495 Flores-Gallegos, N. 4 2023 Two-step, fourteenth-order, phase-fitting procedure with high efficiency and minimal cost for chemical problems. Zbl 07724033 Bao, Wei; Lin, Chia-Liang; Sun, Bin; Simos, T. E. 3 2023 An approach to chemical hardness through Shannon’s entropy. Zbl 07724030 Flores-Gallegos, N.; Flores-Gómez, L. 2 2023 An approach to local electron energy in atoms through Rényi’s entropy. Zbl 07673446 Flores-Gallegos, N. 2 2023 Inverse problem for reconstruction of components from derivative envelope in ovarian MRS: citrate quartet as a cancer biomarker with considerably decreased levels in malignant vs benign samples. Zbl 1511.92034 Belkić, Dževad; Belkić, Karen 2 2023 Comparative analysis of carbon cycle models via kinetic representations. Zbl 1516.92136 Fortun, Noel T.; Mendoza, Eduardo R. 2 2023 Fermi-Dirac entropy as a measure of electron interactions. Zbl 1523.81099 Flores-Gallegos, N. 2 2023 Solution of quantum chemical problems by a very effective and relatively inexpensive two-step, fourteenth-order, phase-fitting procedure. Zbl 07745948 Medvedeva, Marina A.; Simos, T. E. 2 2023 On the information obtained using Shannon’s entropy through spin density. Zbl 1519.92364 Flores-Gallegos, N. 1 2023 Solving singular boundary value problems using higher-order compact finite difference schemes with a novel higher-order implementation of Robin boundary conditions. Zbl 1515.65200 Dlamini, Phumlani; Malele, James; Simelane, Simphiwe 1 2023 Difference methods for stochastic space fractional diffusion equation driven by additive space-time white noise via Wong-Zakai approximation. Zbl 1506.65131 Singh, Abhishek Kumar; Mehra, Mani 1 2023 3-point block backward differentiation formula with an off-step point for the solutions of stiff chemical reaction problems. Zbl 07643851 Soomro, Hira; Zainuddin, Nooraini; Daud, Hanita; Sunday, Joshua; Jamaludin, Noraini; Abdullah, Abdullah; Mulono, Apriyanto; Kadir, Evizal Abdul 1 2023 On the modified generalized multidimensional KP equation in plasma physics and fluid dynamics in \((3+1)\) dimensions. Zbl 1505.35307 Sáez, S. 1 2023 Qualitative analysis and Hopf bifurcation of a generalized Lengyel-Epstein model. Zbl 1506.35007 Chen, Mengxin; Wang, Tian 1 2023 Quantum similarity index and Rényi complexity ratio of Kratzer type potential and compared with that of inverse square and Coulomb type potentials. Zbl 1521.81020 Nath, Debraj; Carbó-Dorca, Ramon 1 2023 Positive equilibria of power law kinetics on networks with independent linkage classes. Zbl 1519.92365 Hernandez, Bryan S.; Mendoza, Eduardo R. 1 2023 Quantum similarity and QSPR in Euclidean-, and Minkowskian-Banach spaces. Zbl 1521.81245 Carbó-Dorca, Ramon 1 2023 Codimension-2 bifurcations on the curve of the Neimark-Sacker bifurcation for a discrete-time chemical model. Zbl 1511.39017 Eskandari, Zohreh; Ghaziani, R. Khoshsiar; Avazzadeh, Zakieh; Li, Bo 1 2023 Analytical solutions of the molecular Kratzer-Feus potential by means of the Nikiforov-Uvarov method. Zbl 1523.81213 Doma, S. B.; Gohar, A. A.; Younes, M. S. 1 2023 A robust numerical technique for weakly coupled system of parabolic singularly perturbed reaction-diffusion equations. Zbl 07695650 Singh, Satpal; Kumar, Devendra; Vigo-Aguiar, J. 1 2023 Some new results on energy of graphs with self loops. Zbl 1516.05131 Popat, Kalpesh M.; Shingala, Kunal R. 1 2023 Solution of quantum chemical problems using an extremely successful and reasonably cost two-step, fourteenth-order phase-fitting approach. Zbl 07745938 Du, Yu; Lin, Chia-Liang; Sun, Bin; Simos, T. E. 1 2023 Theoretical prediction for thermoelastic properties of carbon nanotubes (CNTs) at different pressure or compression using equation of states. Zbl 07745940 Srivastava, Shivam; Pandey, Anjani K.; Dixit, Chandra K. 1 2023 Derivative shape estimations with resolved overlapped peaks and reduced noise for time signals encoded by NMR spectroscopy with and without water suppression. Zbl 1522.92092 Belkić, Dževad; Belkić, Karen 1 2023 Various mechanisms for double capture from helium targets by alpha particles. Zbl 07745954 Belkić, Dževad 1 2023 Sombor index: review of extremal results and bounds. 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Zbl 1502.65046 Singh, Satpal; Kumar, Devendra 1 2022 Global dynamics of solutions for enzyme catalysed models with almost periodic oscillatory input. Zbl 1506.34064 Díaz-Marín, Homero G.; López-Hernández, Francisco J.; Osuna, Osvaldo 1 2022 Average energy and quantum similarity of a time dependent quantum system subject to Pöschl-Teller potential. Zbl 1487.81078 Carbó-Dorca, Ramon; Nath, Debraj 1 2022 A two-step method singularly P-Stable with improved properties for problems in quantum chemistry. Zbl 1487.81087 Medvedeva, Marina A.; Simos, T. E. 1 2022 Determination of unknown molecular properties in molecular spaces. Zbl 07496319 Carbó-Dorca, Ramon 1 2022 Atomic electronegativity based on hardness and floating spherical Gaussian orbital approach. Zbl 1487.81156 Kumari, Varsha; Singh, Tanupriya; Devi, Saroj; Tandon, Hiteshi; Labarca, Martín; Chakraborty, Tanmoy 1 2022 The rotating harmonic oscillator revisited. 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E. 6 2021 High-resolution at 3T for in vivo derivative NMR spectroscopy in medical diagnostics of ovarian tumor: exact quantification by shape estimations. Zbl 1480.92110 Belkić, Dževad; Belkić, Karen 5 2021 Minimum distance-unbalancedness of trees. Zbl 1462.92058 Kramer, Marie; Rautenbach, Dieter 5 2021 Bernstein and Gegenbauer-wavelet collocation methods for Bratu-like equations arising in electrospinning process. Zbl 1480.65192 Shahni, Julee; Singh, Randhir 4 2021 Generalized scalar products in Minkowski metric spaces. Zbl 1467.51004 Carbó-Dorca, Ramon 4 2021 Analytic properties of sextet polynomials of hexagonal systems. Zbl 1462.05188 Li, Guanru; Liu, Lily Li; Wang, Yi 4 2021 A block diagonalization based algorithm for the determinants of block \(k\)-tridiagonal matrices. Zbl 1472.65050 Jia, Ji-Teng; Yan, Yu-Cong; He, Qi 4 2021 Belousov-Zhabotinsky type reactions: the non-linear behavior of chemical systems. 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Zbl 1466.92299 Borisov, Milen; Markov, Svetoslav 4 2021 ...and 1189 more Documents all cited Publications top 5 cited Publications all top 5 Cited by 6,902 Authors 188 Simos, Theodore E. 80 Carbó-Dorca, Ramon 76 Zhang, Heping 64 Gutman, Ivan M. 47 Belkić, Dževad 46 Demiralp, Metin 43 Das, Kinkar Chandra 37 Belkić, Karen 36 Li, Shuchao 36 Liu, Jia-bao 35 Rada, Juan 34 Nalewajski, Roman F. 34 Zhou, Bo 32 Milovanović, Igor Ž. 31 Cordero, Alicia 31 Milovanović, Emina I. 31 Roul, Pradip 31 Torregrosa Sanchez, Juan Ramón 30 Ali, Akbar 30 Alolyan, Ibraheem 30 Došlić, Tomislav 30 Farahani, Mohammad Reza 29 Deng, Hanyuan 26 Imran, Muhammad 25 Chen, Lansun 25 Fujita, Shinsaku 25 Matejić, Marjan M. 24 Craciun, Gheorghe 24 Jia, Jiteng 23 Ashrafi, Ali Reza 23 Balasubramanian, Krishnan 23 Li, Xueliang 23 Sigarreta Almira, José María 22 Ramos, Higinio 22 Vigo-Aguiar, Jesus 21 Argyros, Ioannis Konstantinos 21 Du, Zhibin 21 Fang, Yonglei 21 You, Xiong 20 Lin, Chialiang 20 Rabitz, Herschel A. 20 Rodríguez García, José Manuel 20 Sever, Ramazan 19 Din, Qamar 19 Klavžar, Sandi 19 Rosenfeld, Vladimir Raphael 19 Zhang, Tonghua 18 Behl, Ramandeep 18 Hua, Hongbo 18 Ikhdair, Sameer M. 18 Liu, Hechao 18 Mendoza, Eduardo R. 18 Singh, Randhir 18 Szederkényi, Gábor 17 Furtula, Boris 17 Ivanauskas, Feliksas. F. 17 Jiang, Daqing 17 Mezey, Paul G. 17 Škrekovski, Riste 17 Verma, Amit Kumar 17 Wu, Tingzeng 17 Zhang, Fuji 16 Bersani, Alberto Maria 16 Dehmer, Matthias 16 Klein, Douglas J. 16 Liu, Muhuo 16 Macías-Díaz, Jorge Eduardo 16 Paternoster, Beatrice 16 Spiga, Giampiero 16 Tsitouras, Charalampos 16 Xu, Kexiang 15 Besalú, Emili 15 Bisi, Marzia 15 Chowdhury, Rajib 15 Gao, Wei 15 Ghorbani, Modjtaba 15 Meng, Xinzhu 15 Skakauskas, Vladas 14 Cancan, Murat 14 Fernández, Francisco Marcelo 14 Jahanbani, Akbar 14 Kumar, Sunil 14 Trinajstić, Nenad 14 Walcher, Sebastian 14 Yan, Weigen 14 Yuan, Sanling 13 Akhter, Shehnaz 13 Anastassi, Zacharias A. 13 Balachandran, Selvaraj 13 Banaji, Murad 13 Cruz, Roberto 13 D’Ambrosio, Raffaele 13 Diudea, Mircea V. 13 Gubernov, Vladimir Vladimirovich 13 Mamedov, Bahtiyar A. 13 Medvedev, Maxim A. 13 Pan, Xiangfeng 13 Shi, Yongtang 13 Siddiqui, Muhammad Kamran 13 Wang, Wenhuan ...and 6,802 more Authors all top 5 Cited in 553 Journals 1,484 Journal of Mathematical Chemistry 268 Applied Mathematics and Computation 236 Discrete Applied Mathematics 109 Journal of Computational and Applied Mathematics 92 Linear Algebra and its Applications 69 Journal of Applied Mathematics and Computing 54 Journal of Computational Physics 54 Applied Mathematics Letters 54 MATCH - Communications in Mathematical and in Computer Chemistry 53 Computational and Applied Mathematics 51 Computers & Mathematics with Applications 48 International Journal of Computer Mathematics 48 International Journal of Applied and Computational Mathematics 47 Discrete Mathematics 45 Mathematical Methods in the Applied Sciences 45 Physica A 44 Fractals 44 Advances in Difference Equations 42 Journal of Mathematical Physics 41 Chaos, Solitons and Fractals 39 Mathematics and Computers in Simulation 38 Journal of Theoretical Biology 36 Applied Numerical Mathematics 35 International Journal of Theoretical Physics 35 Discrete Dynamics in Nature and Society 34 Journal of Discrete Mathematical Sciences & Cryptography 33 Computer Physics Communications 32 Journal of Mathematical Biology 32 Numerical Algorithms 32 Mathematical Problems in Engineering 32 Iranian Journal of Mathematical Chemistry 31 Journal of Mathematics 30 Bulletin of Mathematical Biology 30 Applied Mathematical Modelling 30 Journal of Physics A: Mathematical and Theoretical 28 Mathematical Biosciences 27 Discrete Mathematics, Algorithms and Applications 26 Communications in Nonlinear Science and Numerical Simulation 26 Advances in High Energy Physics 25 Journal of Mathematical Analysis and Applications 25 International Journal of Bifurcation and Chaos in Applied Sciences and Engineering 24 Mathematical and Computer Modelling 24 Filomat 24 Nonlinear Analysis. 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