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Impact of cancer chemotherapy before ovarian cortex cryopreservation on ovarian tissue transplantation

Human reproduction (Oxford), 2019-06, Vol.34 (6), p.1083-1094

2019

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Cohesive properties and asymptotics of the dispersion interaction in graphite by the random phase approximation

Physical review letters, 2010-11, Vol.105 (19), p.196401-196401, Article 196401

2010

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Dispersion Corrected Structural Properties and Quasiparticle Band Gaps of Several Organic Energetic Solids

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2015-06, Vol.119 (24), p.6574-6581

2015

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Chalcogen Bonding: Experimental and Theoretical Determinations from Electron Density Analysis. Geometrical Preferences Driven by Electrophilic–Nucleophilic Interactions

Crystal growth & design, 2013-08, Vol.13 (8), p.3283-3289

2013

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Tkatchenko-Scheffler van der Waals correction method with and without self-consistent screening applied to solids

Physical review. B, Condensed matter and materials physics, 2013-02, Vol.87 (6), Article 064110

2013

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Structural, vibrational, and quasiparticle band structure of 1,1-diamino-2,2-dinitroethelene from ab initio calculations

The Journal of chemical physics, 2014-01, Vol.140 (1), p.014105-014105

2014

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A DFT study on structural, vibrational properties, and quasiparticle band structure of solid nitromethane

The Journal of chemical physics, 2013-05, Vol.138 (18), p.184705-184705

2013

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Improved Description of the Structure of Molecular and Layered Crystals: Ab Initio DFT Calculations with van der Waals Corrections

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2010-11, Vol.114 (43), p.11814-11824

2010

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Effect of van der Waals interactions on the structural and elastic properties of black phosphorus

Physical review. B, Condensed matter and materials physics, 2012-07, Vol.86 (3), Article 035105

2012

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A Fractionally Ionic Approach to Polarizability and van der Waals Many-Body Dispersion Calculations

Journal of chemical theory and computation, 2016-12, Vol.12 (12), p.5920-5930

2016

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Improved Density Dependent Correction for the Description of London Dispersion Forces

Journal of chemical theory and computation, 2013-10, Vol.9 (10), p.4293-4299

2013

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Assessing the performance of recent density functionals for bulk solids

Physical review. B, Condensed matter and materials physics, 2009-04, Vol.79 (15), Article 155107

2009

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Extending the applicability of the Tkatchenko-Scheffler dispersion correction via iterative Hirshfeld partitioning

The Journal of chemical physics, 2014-07, Vol.141 (3), p.034114-034114

2014

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Impedance spectroscopy study of a catechol-modified activated carbon electrode as active material in electrochemical capacitor

Journal of power sources, 2015-01, Vol.274, p.551-559

2015

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Structural, elastic, optical properties and quasiparticle band structure of solid cyanuric triazide

Chemical physics letters, 2014-06, Vol.605-606, p.10-15

2014

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Theoretical study of the catalytic hydrodeoxygenation of furan, methylfuran and benzofurane on MoS 2

RSC advances, 2024-07, Vol.14 (31), p.22540-22547

2024

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Conjuring up a ghost: structural and functional characterization of FhuF, a ferric siderophore reductase from E. coli

Journal of biological inorganic chemistry, 2021-05, Vol.26 (2-3), p.313-326

2021

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Gold(I)–Thiolate Coordination Polymers as Multifunctional Materials: The Case of Au(I)–p‑Fluorothiophenolate

ACS applied materials & interfaces, 2024-05, Vol.16 (17), p.22512-22521

2024

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The Black Polymorph of TTF-CA: TTF Polymorphism and Solvent Effects in Mechanochemical and Vapor Digestion Syntheses, FT-IR, Crystal Packing, and Electronic Structure

Crystal growth & design, 2014-01, Vol.14 (1), p.91-100

2014

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Many-body dispersion corrections for periodic systems: an efficient reciprocal space implementation

Journal of physics. Condensed matter, 2016-02, Vol.28 (4), p.045201-045201

2016

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Adsorption of NO, NO2, CO, H2O and CO2 over isolated monovalent cations in faujasite zeolite: a periodic DFT investigation

Theoretical chemistry accounts, 2018-12, Vol.137 (12), p.1-12, Article 161

2018

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Methane emission estimates using chamber and tracer release experiments for a municipal waste water treatment plant

Atmospheric measurement techniques, 2015-07, Vol.8 (7), p.2853-2867

2015

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Performance of CuII‐, PbII‐, and HgII‐Exchanged Mordenite in the Adsorption of I2, ICH3, H2O, CO, ClCH3, and Cl2: A Density Functional Study

Chemphyschem, 2017-06, Vol.18 (12), p.1642-1652

2017

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Spin crossover transition of Fe(phen)2(NCS)2: periodic dispersion-corrected density-functional study

Physical chemistry chemical physics : PCCP, 2012-04, Vol.14 (16), p.5389-5396

2012

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Structural, elastic, and quasiparticle bandstructure of 4,4′-Bis(nitramino)azofurazan from first principles theory

Computational materials science, 2019-11, Vol.169, p.109081, Article 109081

2019

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Impact of cancer chemotherapy before ovarian cortex cryopreservation on ovarian tissue transplantation

Cohesive properties and asymptotics of the dispersion interaction in graphite by the random phase approximation

Dispersion Corrected Structural Properties and Quasiparticle Band Gaps of Several Organic Energetic Solids

Chalcogen Bonding: Experimental and Theoretical Determinations from Electron Density Analysis. Geometrical Preferences Driven by Electrophilic–Nucleophilic Interactions

Tkatchenko-Scheffler van der Waals correction method with and without self-consistent screening applied to solids

Structural, vibrational, and quasiparticle band structure of 1,1-diamino-2,2-dinitroethelene from ab initio calculations

A DFT study on structural, vibrational properties, and quasiparticle band structure of solid nitromethane

Improved Description of the Structure of Molecular and Layered Crystals: Ab Initio DFT Calculations with van der Waals Corrections

Effect of van der Waals interactions on the structural and elastic properties of black phosphorus

A Fractionally Ionic Approach to Polarizability and van der Waals Many-Body Dispersion Calculations

Improved Density Dependent Correction for the Description of London Dispersion Forces

Assessing the performance of recent density functionals for bulk solids

Extending the applicability of the Tkatchenko-Scheffler dispersion correction via iterative Hirshfeld partitioning

Impedance spectroscopy study of a catechol-modified activated carbon electrode as active material in electrochemical capacitor

Structural, elastic, optical properties and quasiparticle band structure of solid cyanuric triazide

Theoretical study of the catalytic hydrodeoxygenation of furan, methylfuran and benzofurane on MoS 2

Conjuring up a ghost: structural and functional characterization of FhuF, a ferric siderophore reductase from E. coli

Gold(I)–Thiolate Coordination Polymers as Multifunctional Materials: The Case of Au(I)–p‑Fluorothiophenolate

The Black Polymorph of TTF-CA: TTF Polymorphism and Solvent Effects in Mechanochemical and Vapor Digestion Syntheses, FT-IR, Crystal Packing, and Electronic Structure

Many-body dispersion corrections for periodic systems: an efficient reciprocal space implementation

Adsorption of NO, NO2, CO, H2O and CO2 over isolated monovalent cations in faujasite zeolite: a periodic DFT investigation

Methane emission estimates using chamber and tracer release experiments for a municipal waste water treatment plant

Performance of CuII‐, PbII‐, and HgII‐Exchanged Mordenite in the Adsorption of I2, ICH3, H2O, CO, ClCH3, and Cl2: A Density Functional Study

Spin crossover transition of Fe(phen)2(NCS)2: periodic dispersion-corrected density-functional study

Structural, elastic, and quasiparticle bandstructure of 4,4′-Bis(nitramino)azofurazan from first principles theory

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