[ERROR] Runtime exception occurred
-402- xtb_calculator_singlepoint: Electronic structure method terminated
-401- scf: Setup of Coulomb evaluator failed
-400- type_latticepoint_update: Could not generate lattice points
-399- xtb_calculator_singlepoint: Electronic structure method terminated
-398- scf: Setup of Coulomb evaluator failed
-397- type_latticepoint_update: Could not generate lattice points
-396- xtb_calculator_singlepoint: Electronic structure method terminated
-395- scf: Setup of Coulomb evaluator failed
-394- type_latticepoint_update: Could not generate lattice points
-393- xtb_calculator_singlepoint: Electronic structure method terminated
-392- scf: Setup of Coulomb evaluator failed
-391- type_latticepoint_update: Could not generate lattice points
-390- xtb_calculator_singlepoint: Electronic structure method terminated
-389- scf: Setup of Coulomb evaluator failed
-388- type_latticepoint_update: Could not generate lattice points
-387- xtb_calculator_singlepoint: Electronic structure method terminated
-386- scf: Setup of Coulomb evaluator failed
-385- type_latticepoint_update: Could not generate lattice points
-384- xtb_calculator_singlepoint: Electronic structure method terminated
-383- scf: Setup of Coulomb evaluator failed
-382- type_latticepoint_update: Could not generate lattice points
-381- xtb_calculator_singlepoint: Electronic structure method terminated
-380- scf: Setup of Coulomb evaluator failed
-379- type_latticepoint_update: Could not generate lattice points
-378- xtb_calculator_singlepoint: Electronic structure method terminated
-377- scf: Setup of Coulomb evaluator failed
-376- type_latticepoint_update: Could not generate lattice points
-375- xtb_calculator_singlepoint: Electronic structure method terminated
-374- scf: Setup of Coulomb evaluator failed
-373- type_latticepoint_update: Could not generate lattice points
-372- xtb_calculator_singlepoint: Electronic structure method terminated
-371- scf: Setup of Coulomb evaluator failed
-370- type_latticepoint_update: Could not generate lattice points
-369- xtb_calculator_singlepoint: Electronic structure method terminated
-368- scf: Setup of Coulomb evaluator failed
-367- type_latticepoint_update: Could not generate lattice points
-366- xtb_calculator_singlepoint: Electronic structure method terminated
-365- scf: Setup of Coulomb evaluator failed
-364- type_latticepoint_update: Could not generate lattice points
-363- xtb_calculator_singlepoint: Electronic structure method terminated
-362- scf: Setup of Coulomb evaluator failed
-361- type_latticepoint_update: Could not generate lattice points
-360- xtb_calculator_singlepoint: Electronic structure method terminated
-359- scf: Setup of Coulomb evaluator failed
-358- type_latticepoint_update: Could not generate lattice points
-357- xtb_calculator_singlepoint: Electronic structure method terminated
-356- scf: Setup of Coulomb evaluator failed
-355- type_latticepoint_update: Could not generate lattice points
-354- xtb_calculator_singlepoint: Electronic structure method terminated
-353- scf: Setup of Coulomb evaluator failed
-352- type_latticepoint_update: Could not generate lattice points
-351- xtb_calculator_singlepoint: Electronic structure method terminated
-350- scf: Setup of Coulomb evaluator failed
-349- type_latticepoint_update: Could not generate lattice points
-348- xtb_calculator_singlepoint: Electronic structure method terminated
-347- scf: Setup of Coulomb evaluator failed
-346- type_latticepoint_update: Could not generate lattice points
-345- xtb_calculator_singlepoint: Electronic structure method terminated
-344- scf: Setup of Coulomb evaluator failed
-343- type_latticepoint_update: Could not generate lattice points
-342- xtb_calculator_singlepoint: Electronic structure method terminated
-341- scf: Setup of Coulomb evaluator failed
-340- type_latticepoint_update: Could not generate lattice points
-339- xtb_calculator_singlepoint: Electronic structure method terminated
-338- scf: Setup of Coulomb evaluator failed
-337- type_latticepoint_update: Could not generate lattice points
-336- xtb_calculator_singlepoint: Electronic structure method terminated
-335- scf: Setup of Coulomb evaluator failed
-334- type_latticepoint_update: Could not generate lattice points
-333- xtb_calculator_singlepoint: Electronic structure method terminated
-332- scf: Setup of Coulomb evaluator failed
-331- type_latticepoint_update: Could not generate lattice points
-330- xtb_calculator_singlepoint: Electronic structure method terminated
-329- scf: Setup of Coulomb evaluator failed
-328- type_latticepoint_update: Could not generate lattice points
-327- xtb_calculator_singlepoint: Electronic structure method terminated
-326- scf: Setup of Coulomb evaluator failed
-325- type_latticepoint_update: Could not generate lattice points
-324- xtb_calculator_singlepoint: Electronic structure method terminated
-323- scf: Setup of Coulomb evaluator failed
-322- type_latticepoint_update: Could not generate lattice points
-321- xtb_calculator_singlepoint: Electronic structure method terminated
-320- scf: Setup of Coulomb evaluator failed
-319- type_latticepoint_update: Could not generate lattice points
-318- xtb_calculator_singlepoint: Electronic structure method terminated
-317- scf: Setup of Coulomb evaluator failed
-316- type_latticepoint_update: Could not generate lattice points
-315- optimizer_ancopt: Calculation of model hessian failed
-314- optimizer_ancopt: Calculation of model hessian failed
-313- optimizer_ancopt: Calculation of model hessian failed
-312- optimizer_ancopt: Calculation of model hessian failed
-311- optimizer_ancopt: Calculation of model hessian failed
-310- optimizer_ancopt: Calculation of model hessian failed
-309- optimizer_ancopt: Calculation of model hessian failed
-308- optimizer_ancopt: Calculation of model hessian failed
-307- optimizer_ancopt: Calculation of model hessian failed
-306- optimizer_ancopt: Calculation of model hessian failed
-305- optimizer_ancopt: Calculation of model hessian failed
-304- optimizer_ancopt: Calculation of model hessian failed
-303- optimizer_ancopt: Calculation of model hessian failed
-302- optimizer_ancopt: Calculation of model hessian failed
-301- optimizer_ancopt: Calculation of model hessian failed
-300- optimizer_ancopt: Calculation of model hessian failed
-299- optimizer_ancopt: Calculation of model hessian failed
-298- optimizer_ancopt: Calculation of model hessian failed
-297- optimizer_ancopt: Calculation of model hessian failed
-296- optimizer_ancopt: Calculation of model hessian failed
-295- optimizer_ancopt: Calculation of model hessian failed
-294- optimizer_ancopt: Calculation of model hessian failed
-293- optimizer_ancopt: Calculation of model hessian failed
-292- optimizer_ancopt: Calculation of model hessian failed
-291- optimizer_ancopt: Calculation of model hessian failed
-290- optimizer_ancopt: Calculation of model hessian failed
-289- optimizer_ancopt: Calculation of model hessian failed
-288- optimizer_ancopt: Calculation of model hessian failed
-287- optimizer_ancopt: Calculation of model hessian failed
-286- xtb_calculator_singlepoint: Electronic structure method terminated
-285- scf: Setup of Coulomb evaluator failed
-284- type_latticepoint_update: Could not generate lattice points
-283- xtb_calculator_singlepoint: Electronic structure method terminated
-282- scf: Setup of Coulomb evaluator failed
-281- type_latticepoint_update: Could not generate lattice points
-280- xtb_calculator_singlepoint: Electronic structure method terminated
-279- scf: Setup of Coulomb evaluator failed
-278- type_latticepoint_update: Could not generate lattice points
-277- xtb_calculator_singlepoint: Electronic structure method terminated
-276- scf: Setup of Coulomb evaluator failed
-275- type_latticepoint_update: Could not generate lattice points
-274- xtb_calculator_singlepoint: Electronic structure method terminated
-273- scf: Setup of Coulomb evaluator failed
-272- type_latticepoint_update: Could not generate lattice points
-271- xtb_calculator_singlepoint: Electronic structure method terminated
-270- scf: Setup of Coulomb evaluator failed
-269- type_latticepoint_update: Could not generate lattice points
-268- xtb_calculator_singlepoint: Electronic structure method terminated
-267- scf: Setup of Coulomb evaluator failed
-266- type_latticepoint_update: Could not generate lattice points
-265- xtb_calculator_singlepoint: Electronic structure method terminated
-264- scf: Setup of Coulomb evaluator failed
-263- type_latticepoint_update: Could not generate lattice points
-262- xtb_calculator_singlepoint: Electronic structure method terminated
-261- scf: Setup of Coulomb evaluator failed
-260- type_latticepoint_update: Could not generate lattice points
-259- xtb_calculator_singlepoint: Electronic structure method terminated
-258- scf: Setup of Coulomb evaluator failed
-257- type_latticepoint_update: Could not generate lattice points
-256- xtb_calculator_singlepoint: Electronic structure method terminated
-255- scf: Setup of Coulomb evaluator failed
-254- type_latticepoint_update: Could not generate lattice points
-253- xtb_calculator_singlepoint: Electronic structure method terminated
-252- scf: Setup of Coulomb evaluator failed
-251- type_latticepoint_update: Could not generate lattice points
-250- xtb_calculator_singlepoint: Electronic structure method terminated
-249- scf: Setup of Coulomb evaluator failed
-248- type_latticepoint_update: Could not generate lattice points
-247- xtb_calculator_singlepoint: Electronic structure method terminated
-246- scf: Setup of Coulomb evaluator failed
-245- type_latticepoint_update: Could not generate lattice points
-244- xtb_calculator_singlepoint: Electronic structure method terminated
-243- scf: Setup of Coulomb evaluator failed
-242- type_latticepoint_update: Could not generate lattice points
-241- xtb_calculator_singlepoint: Electronic structure method terminated
-240- scf: Setup of Coulomb evaluator failed
-239- type_latticepoint_update: Could not generate lattice points
-238- xtb_calculator_singlepoint: Electronic structure method terminated
-237- scf: Setup of Coulomb evaluator failed
-236- type_latticepoint_update: Could not generate lattice points
-235- xtb_calculator_singlepoint: Electronic structure method terminated
-234- scf: Setup of Coulomb evaluator failed
-233- type_latticepoint_update: Could not generate lattice points
-232- xtb_calculator_singlepoint: Electronic structure method terminated
-231- scf: Setup of Coulomb evaluator failed
-230- type_latticepoint_update: Could not generate lattice points
-229- xtb_calculator_singlepoint: Electronic structure method terminated
-228- scf: Setup of Coulomb evaluator failed
-227- type_latticepoint_update: Could not generate lattice points
-226- xtb_calculator_singlepoint: Electronic structure method terminated
-225- scf: Setup of Coulomb evaluator failed
-224- type_latticepoint_update: Could not generate lattice points
-223- xtb_calculator_singlepoint: Electronic structure method terminated
-222- scf: Setup of Coulomb evaluator failed
-221- type_latticepoint_update: Could not generate lattice points
-220- xtb_calculator_singlepoint: Electronic structure method terminated
-219- scf: Setup of Coulomb evaluator failed
-218- type_latticepoint_update: Could not generate lattice points
-217- xtb_calculator_singlepoint: Electronic structure method terminated
-216- scf: Setup of Coulomb evaluator failed
-215- type_latticepoint_update: Could not generate lattice points
-214- xtb_calculator_singlepoint: Electronic structure method terminated
-213- scf: Setup of Coulomb evaluator failed
-212- type_latticepoint_update: Could not generate lattice points
-211- xtb_calculator_singlepoint: Electronic structure method terminated
-210- scf: Setup of Coulomb evaluator failed
-209- type_latticepoint_update: Could not generate lattice points
-208- xtb_calculator_singlepoint: Electronic structure method terminated
-207- scf: Setup of Coulomb evaluator failed
-206- type_latticepoint_update: Could not generate lattice points
-205- xtb_calculator_singlepoint: Electronic structure method terminated
-204- scf: Setup of Coulomb evaluator failed
-203- type_latticepoint_update: Could not generate lattice points
-202- xtb_calculator_singlepoint: Electronic structure method terminated
-201- scf: Setup of Coulomb evaluator failed
-200- type_latticepoint_update: Could not generate lattice points
-199- xtb_calculator_singlepoint: Electronic structure method terminated
-198- scf: Setup of Coulomb evaluator failed
-197- type_latticepoint_update: Could not generate lattice points
-196- xtb_calculator_singlepoint: Electronic structure method terminated
-195- scf: Setup of Coulomb evaluator failed
-194- type_latticepoint_update: Could not generate lattice points
-193- xtb_calculator_singlepoint: Electronic structure method terminated
-192- scf: Setup of Coulomb evaluator failed
-191- type_latticepoint_update: Could not generate lattice points
-190- xtb_calculator_singlepoint: Electronic structure method terminated
-189- scf: Setup of Coulomb evaluator failed
-188- type_latticepoint_update: Could not generate lattice points
-187- xtb_calculator_singlepoint: Electronic structure method terminated
-186- scf: Setup of Coulomb evaluator failed
-185- type_latticepoint_update: Could not generate lattice points
-184- xtb_calculator_singlepoint: Electronic structure method terminated
-183- scf: Setup of Coulomb evaluator failed
-182- type_latticepoint_update: Could not generate lattice points
-181- xtb_calculator_singlepoint: Electronic structure method terminated
-180- scf: Setup of Coulomb evaluator failed
-179- type_latticepoint_update: Could not generate lattice points
-178- xtb_calculator_singlepoint: Electronic structure method terminated
-177- scf: Setup of Coulomb evaluator failed
-176- type_latticepoint_update: Could not generate lattice points
-175- xtb_calculator_singlepoint: Electronic structure method terminated
-174- scf: Setup of Coulomb evaluator failed
-173- type_latticepoint_update: Could not generate lattice points
-172- xtb_calculator_singlepoint: Electronic structure method terminated
-171- scf: Setup of Coulomb evaluator failed
-170- type_latticepoint_update: Could not generate lattice points
-169- xtb_calculator_singlepoint: Electronic structure method terminated
-168- scf: Setup of Coulomb evaluator failed
-167- type_latticepoint_update: Could not generate lattice points
-166- xtb_calculator_singlepoint: Electronic structure method terminated
-165- scf: Setup of Coulomb evaluator failed
-164- type_latticepoint_update: Could not generate lattice points
-163- xtb_calculator_singlepoint: Electronic structure method terminated
-162- scf: Setup of Coulomb evaluator failed
-161- type_latticepoint_update: Could not generate lattice points
-160- xtb_calculator_singlepoint: Electronic structure method terminated
-159- scf: Setup of Coulomb evaluator failed
-158- type_latticepoint_update: Could not generate lattice points
-157- xtb_calculator_singlepoint: Electronic structure method terminated
-156- scf: Setup of Coulomb evaluator failed
-155- type_latticepoint_update: Could not generate lattice points
-154- xtb_calculator_singlepoint: Electronic structure method terminated
-153- scf: Setup of Coulomb evaluator failed
-152- type_latticepoint_update: Could not generate lattice points
-151- xtb_calculator_singlepoint: Electronic structure method terminated
-150- scf: Setup of Coulomb evaluator failed
-149- type_latticepoint_update: Could not generate lattice points
-148- xtb_calculator_singlepoint: Electronic structure method terminated
-147- scf: Setup of Coulomb evaluator failed
-146- type_latticepoint_update: Could not generate lattice points
-145- xtb_calculator_singlepoint: Electronic structure method terminated
-144- scf: Setup of Coulomb evaluator failed
-143- type_latticepoint_update: Could not generate lattice points
-142- xtb_calculator_singlepoint: Electronic structure method terminated
-141- scf: Setup of Coulomb evaluator failed
-140- type_latticepoint_update: Could not generate lattice points
-139- xtb_calculator_singlepoint: Electronic structure method terminated
-138- scf: Setup of Coulomb evaluator failed
-137- type_latticepoint_update: Could not generate lattice points
-136- xtb_calculator_singlepoint: Electronic structure method terminated
-135- scf: Setup of Coulomb evaluator failed
-134- type_latticepoint_update: Could not generate lattice points
-133- xtb_calculator_singlepoint: Electronic structure method terminated
-132- scf: Setup of Coulomb evaluator failed
-131- type_latticepoint_update: Could not generate lattice points
-130- xtb_calculator_singlepoint: Electronic structure method terminated
-129- scf: Setup of Coulomb evaluator failed
-128- type_latticepoint_update: Could not generate lattice points
-127- xtb_calculator_singlepoint: Electronic structure method terminated
-126- scf: Setup of Coulomb evaluator failed
-125- type_latticepoint_update: Could not generate lattice points
-124- xtb_calculator_singlepoint: Electronic structure method terminated
-123- scf: Setup of Coulomb evaluator failed
-122- type_latticepoint_update: Could not generate lattice points
-121- xtb_calculator_singlepoint: Electronic structure method terminated
-120- scf: Setup of Coulomb evaluator failed
-119- type_latticepoint_update: Could not generate lattice points
-118- xtb_calculator_singlepoint: Electronic structure method terminated
-117- scf: Setup of Coulomb evaluator failed
-116- type_latticepoint_update: Could not generate lattice points
-115- xtb_calculator_singlepoint: Electronic structure method terminated
-114- scf: Setup of Coulomb evaluator failed
-113- type_latticepoint_update: Could not generate lattice points
-112- xtb_calculator_singlepoint: Electronic structure method terminated
-111- scf: Setup of Coulomb evaluator failed
-110- type_latticepoint_update: Could not generate lattice points
-109- xtb_calculator_singlepoint: Electronic structure method terminated
-108- scf: Setup of Coulomb evaluator failed
-107- type_latticepoint_update: Could not generate lattice points
-106- xtb_calculator_singlepoint: Electronic structure method terminated
-105- scf: Setup of Coulomb evaluator failed
-104- type_latticepoint_update: Could not generate lattice points
-103- xtb_calculator_singlepoint: Electronic structure method terminated
-102- scf: Setup of Coulomb evaluator failed
-101- type_latticepoint_update: Could not generate lattice points
-100- optimizer_ancopt: Calculation of model hessian failed
-99- xtb_calculator_singlepoint: Electronic structure method terminated
-98- scf: Setup of Coulomb evaluator failed
-97- type_latticepoint_update: Could not generate lattice points
-96- xtb_calculator_singlepoint: Electronic structure method terminated
-95- scf: Setup of Coulomb evaluator failed
-94- type_latticepoint_update: Could not generate lattice points
-93- xtb_calculator_singlepoint: Electronic structure method terminated
-92- scf: Setup of Coulomb evaluator failed
-91- type_latticepoint_update: Could not generate lattice points
-90- xtb_calculator_singlepoint: Electronic structure method terminated
-89- scf: Setup of Coulomb evaluator failed
-88- type_latticepoint_update: Could not generate lattice points
-87- xtb_calculator_singlepoint: Electronic structure method terminated
-86- scf: Setup of Coulomb evaluator failed
-85- type_latticepoint_update: Could not generate lattice points
-84- xtb_calculator_singlepoint: Electronic structure method terminated
-83- scf: Setup of Coulomb evaluator failed
-82- type_latticepoint_update: Could not generate lattice points
-81- xtb_calculator_singlepoint: Electronic structure method terminated
-80- scf: Setup of Coulomb evaluator failed
-79- type_latticepoint_update: Could not generate lattice points
-78- xtb_calculator_singlepoint: Electronic structure method terminated
-77- scf: Setup of Coulomb evaluator failed
-76- type_latticepoint_update: Could not generate lattice points
-75- xtb_calculator_singlepoint: Electronic structure method terminated
-74- scf: Setup of Coulomb evaluator failed
-73- type_latticepoint_update: Could not generate lattice points
-72- xtb_calculator_singlepoint: Electronic structure method terminated
-71- scf: Setup of Coulomb evaluator failed
-70- type_latticepoint_update: Could not generate lattice points
-69- xtb_calculator_singlepoint: Electronic structure method terminated
-68- scf: Setup of Coulomb evaluator failed
-67- type_latticepoint_update: Could not generate lattice points
-66- xtb_calculator_singlepoint: Electronic structure method terminated
-65- scf: Setup of Coulomb evaluator failed
-64- type_latticepoint_update: Could not generate lattice points
-63- xtb_calculator_singlepoint: Electronic structure method terminated
-62- scf: Setup of Coulomb evaluator failed
-61- type_latticepoint_update: Could not generate lattice points
-60- xtb_calculator_singlepoint: Electronic structure method terminated
-59- scf: Setup of Coulomb evaluator failed
-58- type_latticepoint_update: Could not generate lattice points
-57- xtb_calculator_singlepoint: Electronic structure method terminated
-56- scf: Setup of Coulomb evaluator failed
-55- type_latticepoint_update: Could not generate lattice points
-54- xtb_calculator_singlepoint: Electronic structure method terminated
-53- scf: Setup of Coulomb evaluator failed
-52- type_latticepoint_update: Could not generate lattice points
-51- xtb_calculator_singlepoint: Electronic structure method terminated
-50- scf: Setup of Coulomb evaluator failed
-49- type_latticepoint_update: Could not generate lattice points
-48- xtb_calculator_singlepoint: Electronic structure method terminated
-47- scf: Setup of Coulomb evaluator failed
-46- type_latticepoint_update: Could not generate lattice points
-45- xtb_calculator_singlepoint: Electronic structure method terminated
-44- scf: Setup of Coulomb evaluator failed
-43- type_latticepoint_update: Could not generate lattice points
-42- xtb_calculator_singlepoint: Electronic structure method terminated
-41- scf: Setup of Coulomb evaluator failed
-40- type_latticepoint_update: Could not generate lattice points
-39- xtb_calculator_singlepoint: Electronic structure method terminated
-38- scf: Setup of Coulomb evaluator failed
-37- type_latticepoint_update: Could not generate lattice points
-36- xtb_calculator_singlepoint: Electronic structure method terminated
-35- scf: Setup of Coulomb evaluator failed
-34- type_latticepoint_update: Could not generate lattice points
-33- xtb_calculator_singlepoint: Electronic structure method terminated
-32- scf: Setup of Coulomb evaluator failed
-31- type_latticepoint_update: Could not generate lattice points
-30- xtb_calculator_singlepoint: Electronic structure method terminated
-29- scf: Setup of Coulomb evaluator failed
-28- type_latticepoint_update: Could not generate lattice points
-27- xtb_calculator_singlepoint: Electronic structure method terminated
-26- scf: Setup of Coulomb evaluator failed
-25- type_latticepoint_update: Could not generate lattice points
-24- xtb_calculator_singlepoint: Electronic structure method terminated
-23- scf: Setup of Coulomb evaluator failed
-22- type_latticepoint_update: Could not generate lattice points
-21- xtb_calculator_singlepoint: Electronic structure method terminated
-20- scf: Setup of Coulomb evaluator failed
-19- type_latticepoint_update: Could not generate lattice points
-18- xtb_calculator_singlepoint: Electronic structure method terminated
-17- scf: Setup of Coulomb evaluator failed
-16- type_latticepoint_update: Could not generate lattice points
-15- xtb_calculator_singlepoint: Electronic structure method terminated
-14- scf: Setup of Coulomb evaluator failed
-13- type_latticepoint_update: Could not generate lattice points
-12- xtb_calculator_singlepoint: Electronic structure method terminated
-11- scf: Setup of Coulomb evaluator failed
-10- type_latticepoint_update: Could not generate lattice points
-9- xtb_calculator_singlepoint: Electronic structure method terminated
-8- scf: Setup of Coulomb evaluator failed
-7- type_latticepoint_update: Could not generate lattice points
-6- optimizer_ancopt: Could not relax structure
-5- optimizer_relax: SCF not converged, aborting...
-4- xtb_calculator_singlepoint: Electronic structure method terminated
-3- scf: Self consistent charge iterator did not converge
-2- restart_readRestart: Multiplicity missmatch in restart file.
-1- restart_readRestart: Number of electron missmatch in restart file.
########################################################################