Mihály Kállay - ODT Personal data sheet


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Personal data sheet

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personal data approved: 2022. X. 06.

Personal data

name	Mihály Kállay
name of institution	Budapest University of Technology and Economics
doctoral school	BME George A. Olah Doctoral School of Chemistry and Chemical Technology (Core member) Council of the Doctoral School (discipline) Habilitation Comittee and Doctoral Council
accreditation statement submitted to:	Budapest University of Technology and Economics

Contact details
E-mail address	kallay.mihalyvbk.bme.hu
phone number	+36 1 463-1623
	own web page

Academic title
scientific degree, title	Ph.D.
year degree was obtained	2001
discipline to which degree belongs	chemistry
institution granting the degree	ELTE (to be translated)
scientific degree, title	DSc
year degree was obtained	2013
discipline to which degree belongs	chemistry
institution granting the degree	HAS
scientific degree, title	Habilitation
year degree was obtained	2014
discipline to which degree belongs	chemistry
institution granting the degree	Budapest University of Technology and Economics

Employment
2004 -	Budapest University of Technology and Economics university professor or researcher

Thesis topic supervisor

number of doctoral students supervised until now

number of students who fulfilled course requirements

students who obtained their degrees:

Dávid Mester	PhD	2020	GAODSCC
Bence Hégely	PhD	2019	GAODSCC
Gyula Samu	PhD	2019	GAODSCC

completed course requirement:

József Csóka

(PhD)

2023/08

GAODSCC

Thesis topic proposals

Research
research area	theoretical chemistry
research field in which current research is conducted	chemistry physics

Publications

2020

Kállay Mihály, Nagy Péter R., Mester Dávid, Rolik Zoltán, Samu Gyula, Csontos József, Csóka József, Szabó P. Bernát, Gyevi-Nagy László, Hégely Bence, Ladjánszki István, Szegedy Lóránt, Ladóczki Bence, Petrov Klára, Farkas Máté, Mezei Pál D., Ganyecz Ádám: The MRCC program system: Accurate quantum chemistry from water to proteins, JOURNAL OF CHEMICAL PHYSICS 152: (7) p. 074107.
type of document: Journal paper/Article
number of independent citations: 64
language: English
URL

2019

Nagy Péter R., Kállay Mihály: Approaching the Basis Set Limit of CCSD(T) Energies for Large Molecules with Local Natural Orbital Coupled-Cluster Methods, JOURNAL OF CHEMICAL THEORY AND COMPUTATION 15: (10) pp. 5275-5298.
type of document: Journal paper/Article
number of independent citations: 24
language: English
URL

2018

Dávid Mester, Péter R Nagy, Mihály Kállay: Reduced-cost second-order algebraic-diagrammatic construction method for excitation energies and transition moments, JOURNAL OF CHEMICAL PHYSICS 148: (9) 094111
type of document: Journal paper/Article
number of independent citations: 13
language: English
URL

2018

Bence Hégely, Péter R Nagy, Mihaly Kallay: Dual basis set approach for density functional and wave function embedding schemes, JOURNAL OF CHEMICAL THEORY AND COMPUTATION 14: (9) pp. 4600-4615.
type of document: Journal paper/Article
number of independent citations: 15
language: English
URL

2018

Péter R Nagy, Gyula Samu, Mihaly Kallay: Optimization of the linear-scaling local natural orbital CCSD(T) method: improved algorithm and benchmark applications, JOURNAL OF CHEMICAL THEORY AND COMPUTATION 14: (8) pp. 4193-4215.
type of document: Journal paper/Article
number of independent citations: 31
language: English
URL

2005

Kallay M, Gauss J: Approximate treatment of higher excitations in coupled-cluster theory, JOURNAL OF CHEMICAL PHYSICS 123: 214105
type of document: Journal paper/Article
number of independent citations: 238
language: English
URL

2004

Kallay M, Gauss J: Calculation of excited-state properties using general coupled-cluster and configuration-interaction models, JOURNAL OF CHEMICAL PHYSICS 121: pp. 9257-9269.
type of document: Journal paper/Article
number of independent citations: 255
language: English
URL

2004

Tajti A, Szalay PG, Császár AG, Kállay M, Gauss J, Valeev EF, Flowers BA, Vazquéz J, Stanton JF: HEAT: High Accuracy Extrapolated Ab Initio Thermochemistry, JOURNAL OF CHEMICAL PHYSICS 121: (23) pp. 11599-11613.
type of document: Journal paper/Article
number of independent citations: 473
language: English
URL

2004

Boese AD, Oren M, Atasoylu O, Martin JML, Kallay M, Gauss J: W3 theory: Robust computational thermochemistry in the kJ/mol accuracy range, JOURNAL OF CHEMICAL PHYSICS 120: pp. 4129-4141.
type of document: Journal paper/Article
number of independent citations: 313
language: English
URL

2001

Kallay M, Surjan PR: Higher excitations in coupled-cluster theory, JOURNAL OF CHEMICAL PHYSICS 115: pp. 2945-2954.
type of document: Journal paper/Article
number of independent citations: 557
language: English
URL

Number of independent citations to these publications:

1983

Scientometric data

list of publications and citations

number of scientific publications that meet accreditation criteria:

163

number of scientific publications:

165

monographs and professional books:

monographs/books in which chapters/sections were contributed:

scientific publications published abroad that meet the accreditation criteria:

159

publications not in Hungarian, published in Hungary, meeting the accreditation criteria:

number of independent citations to scientific publications and creative works:

6707